USER MOD reduce.3.24.130724 H: found=0, std=0, add=761, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 761 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 48 GLN :FLIP amide:sc= -4.31! C(o=-6!,f=-3.7!) USER MOD Set 1.2: A 68 SER OG : rot 168:sc= 0.576 USER MOD Single : A 14 GLN : amide:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 16 THR OG1 : rot 130:sc= -1.59! USER MOD Single : A 18 THR OG1 : rot 180:sc= -1.04 USER MOD Single : A 20 GLN : amide:sc= -0.195 X(o=-0.19,f=-0.67) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 SER OG : rot -60:sc= -3.07! USER MOD Single : A 26 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0196) USER MOD Single : A 27 LYS NZ :NH3+ 149:sc= -0.213 (180deg=-1.19!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 TYR OH : rot 150:sc= -1.59! USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 19:sc= 0.824 USER MOD Single : A 49 HIS : no HD1:sc= -3.63! C(o=-3.6!,f=-4.3!) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 154:sc= -0.91 (180deg=-1.58!) USER MOD Single : A 60 LYS NZ :NH3+ 162:sc= -2.74! (180deg=-3.71!) USER MOD Single : A 62 ASN : amide:sc= -3.35! C(o=-3.3!,f=-2.9!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 SER OG : rot -38:sc= 0.653 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 ASN : amide:sc= -1.99! C(o=-2!,f=-2.1!) USER MOD Single : A 81 MET CE :methyl -106:sc= -0.851 (180deg=-5.54!) USER MOD Single : A 82 SER OG : rot 120:sc= -3.89! USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 MET CE :methyl -125:sc= -2.43! (180deg=-4.69!) USER MOD Single : A 88 ASN : amide:sc= -0.194 X(o=-0.19,f=-0.19) USER MOD Single : A 96 THR OG1 : rot 180:sc= -4.41! USER MOD Single : A 99 SER OG : rot -150:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 TYR OH : rot 150:sc= 0 USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 175 N VAL A 13 -7.499 16.962 -7.067 1.00 0.00 N ATOM 176 CA VAL A 13 -7.859 18.198 -7.816 1.00 0.00 C ATOM 177 C VAL A 13 -6.683 18.623 -8.698 1.00 0.00 C ATOM 178 O VAL A 13 -5.542 18.599 -8.278 1.00 0.00 O ATOM 179 CB VAL A 13 -8.179 19.317 -6.823 1.00 0.00 C ATOM 180 CG1 VAL A 13 -8.846 20.478 -7.561 1.00 0.00 C ATOM 181 CG2 VAL A 13 -9.127 18.786 -5.745 1.00 0.00 C ATOM 0 HA VAL A 13 -8.730 18.003 -8.442 1.00 0.00 H new ATOM 0 HB VAL A 13 -7.257 19.664 -6.357 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -9.074 21.276 -6.854 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -8.172 20.856 -8.329 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -9.768 20.131 -8.027 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -9.356 19.583 -5.037 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -10.049 18.439 -6.211 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -8.652 17.958 -5.219 1.00 0.00 H new ATOM 191 N GLN A 14 -6.945 19.015 -9.916 1.00 0.00 N ATOM 192 CA GLN A 14 -5.831 19.440 -10.810 1.00 0.00 C ATOM 193 C GLN A 14 -5.905 20.952 -11.033 1.00 0.00 C ATOM 194 O GLN A 14 -6.892 21.471 -11.516 1.00 0.00 O ATOM 195 CB GLN A 14 -5.947 18.716 -12.153 1.00 0.00 C ATOM 196 CG GLN A 14 -5.716 17.218 -11.948 1.00 0.00 C ATOM 197 CD GLN A 14 -5.880 16.488 -13.282 1.00 0.00 C ATOM 198 OE1 GLN A 14 -6.919 16.570 -13.909 1.00 0.00 O ATOM 199 NE2 GLN A 14 -4.893 15.772 -13.747 1.00 0.00 N ATOM 0 H GLN A 14 -7.877 19.059 -10.328 1.00 0.00 H new ATOM 0 HA GLN A 14 -4.877 19.189 -10.346 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -6.933 18.887 -12.586 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -5.216 19.114 -12.857 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -4.717 17.045 -11.547 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -6.425 16.827 -11.218 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -4.021 15.703 -13.222 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -4.993 15.282 -14.636 1.00 0.00 H new ATOM 208 N VAL A 15 -4.871 21.665 -10.676 1.00 0.00 N ATOM 209 CA VAL A 15 -4.884 23.144 -10.859 1.00 0.00 C ATOM 210 C VAL A 15 -3.614 23.586 -11.592 1.00 0.00 C ATOM 211 O VAL A 15 -2.538 23.079 -11.347 1.00 0.00 O ATOM 212 CB VAL A 15 -4.939 23.821 -9.491 1.00 0.00 C ATOM 213 CG1 VAL A 15 -5.317 25.293 -9.660 1.00 0.00 C ATOM 214 CG2 VAL A 15 -5.985 23.123 -8.619 1.00 0.00 C ATOM 0 H VAL A 15 -4.018 21.286 -10.265 1.00 0.00 H new ATOM 0 HA VAL A 15 -5.757 23.428 -11.447 1.00 0.00 H new ATOM 0 HB VAL A 15 -3.961 23.752 -9.014 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -5.355 25.773 -8.682 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -4.572 25.791 -10.280 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -6.294 25.365 -10.138 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -6.025 23.605 -7.642 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -6.962 23.191 -9.098 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -5.714 22.075 -8.495 1.00 0.00 H new ATOM 224 N THR A 16 -3.730 24.527 -12.490 1.00 0.00 N ATOM 225 CA THR A 16 -2.527 24.999 -13.234 1.00 0.00 C ATOM 226 C THR A 16 -2.607 26.516 -13.428 1.00 0.00 C ATOM 227 O THR A 16 -3.671 27.073 -13.606 1.00 0.00 O ATOM 228 CB THR A 16 -2.472 24.311 -14.601 1.00 0.00 C ATOM 229 OG1 THR A 16 -3.537 24.787 -15.411 1.00 0.00 O ATOM 230 CG2 THR A 16 -2.605 22.799 -14.417 1.00 0.00 C ATOM 0 H THR A 16 -4.604 24.989 -12.740 1.00 0.00 H new ATOM 0 HA THR A 16 -1.629 24.754 -12.666 1.00 0.00 H new ATOM 0 HB THR A 16 -1.520 24.534 -15.084 1.00 0.00 H new ATOM 0 HG1 THR A 16 -3.186 25.063 -16.283 1.00 0.00 H new ATOM 0 HG21 THR A 16 -2.566 22.309 -15.390 1.00 0.00 H new ATOM 0 HG22 THR A 16 -1.788 22.435 -13.794 1.00 0.00 H new ATOM 0 HG23 THR A 16 -3.556 22.573 -13.935 1.00 0.00 H new ATOM 238 N PHE A 17 -1.487 27.190 -13.394 1.00 0.00 N ATOM 239 CA PHE A 17 -1.501 28.671 -13.576 1.00 0.00 C ATOM 240 C PHE A 17 -0.737 29.039 -14.849 1.00 0.00 C ATOM 241 O PHE A 17 0.338 28.535 -15.105 1.00 0.00 O ATOM 242 CB PHE A 17 -0.822 29.340 -12.380 1.00 0.00 C ATOM 243 CG PHE A 17 -1.602 29.052 -11.122 1.00 0.00 C ATOM 244 CD1 PHE A 17 -1.384 27.863 -10.418 1.00 0.00 C ATOM 245 CD2 PHE A 17 -2.541 29.980 -10.655 1.00 0.00 C ATOM 246 CE1 PHE A 17 -2.103 27.600 -9.247 1.00 0.00 C ATOM 247 CE2 PHE A 17 -3.261 29.718 -9.484 1.00 0.00 C ATOM 248 CZ PHE A 17 -3.041 28.527 -8.780 1.00 0.00 C ATOM 0 H PHE A 17 -0.565 26.779 -13.248 1.00 0.00 H new ATOM 0 HA PHE A 17 -2.533 29.012 -13.654 1.00 0.00 H new ATOM 0 HB2 PHE A 17 0.199 28.973 -12.278 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -0.759 30.416 -12.541 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -0.660 27.147 -10.779 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -2.710 30.898 -11.199 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -1.934 26.682 -8.704 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -3.985 30.433 -9.123 1.00 0.00 H new ATOM 0 HZ PHE A 17 -3.596 28.324 -7.876 1.00 0.00 H new ATOM 258 N THR A 18 -1.277 29.920 -15.646 1.00 0.00 N ATOM 259 CA THR A 18 -0.567 30.320 -16.895 1.00 0.00 C ATOM 260 C THR A 18 -0.613 31.845 -17.041 1.00 0.00 C ATOM 261 O THR A 18 -1.660 32.453 -16.954 1.00 0.00 O ATOM 262 CB THR A 18 -1.243 29.666 -18.103 1.00 0.00 C ATOM 263 OG1 THR A 18 -1.370 28.270 -17.873 1.00 0.00 O ATOM 264 CG2 THR A 18 -0.399 29.904 -19.356 1.00 0.00 C ATOM 0 H THR A 18 -2.174 30.378 -15.488 1.00 0.00 H new ATOM 0 HA THR A 18 0.471 29.992 -16.844 1.00 0.00 H new ATOM 0 HB THR A 18 -2.231 30.103 -18.247 1.00 0.00 H new ATOM 0 HG1 THR A 18 -1.804 27.849 -18.645 1.00 0.00 H new ATOM 0 HG21 THR A 18 -0.882 29.437 -20.214 1.00 0.00 H new ATOM 0 HG22 THR A 18 -0.303 30.975 -19.532 1.00 0.00 H new ATOM 0 HG23 THR A 18 0.591 29.469 -19.216 1.00 0.00 H new ATOM 272 N VAL A 19 0.515 32.465 -17.262 1.00 0.00 N ATOM 273 CA VAL A 19 0.531 33.949 -17.414 1.00 0.00 C ATOM 274 C VAL A 19 0.008 34.322 -18.802 1.00 0.00 C ATOM 275 O VAL A 19 0.368 33.714 -19.791 1.00 0.00 O ATOM 276 CB VAL A 19 1.965 34.465 -17.258 1.00 0.00 C ATOM 277 CG1 VAL A 19 1.964 35.996 -17.285 1.00 0.00 C ATOM 278 CG2 VAL A 19 2.541 33.978 -15.927 1.00 0.00 C ATOM 0 H VAL A 19 1.424 32.010 -17.344 1.00 0.00 H new ATOM 0 HA VAL A 19 -0.103 34.399 -16.650 1.00 0.00 H new ATOM 0 HB VAL A 19 2.577 34.089 -18.078 1.00 0.00 H new ATOM 0 HG11 VAL A 19 2.985 36.363 -17.174 1.00 0.00 H new ATOM 0 HG12 VAL A 19 1.555 36.343 -18.234 1.00 0.00 H new ATOM 0 HG13 VAL A 19 1.352 36.374 -16.466 1.00 0.00 H new ATOM 0 HG21 VAL A 19 3.561 34.345 -15.816 1.00 0.00 H new ATOM 0 HG22 VAL A 19 1.929 34.353 -15.107 1.00 0.00 H new ATOM 0 HG23 VAL A 19 2.544 32.888 -15.909 1.00 0.00 H new ATOM 288 N GLN A 20 -0.839 35.310 -18.888 1.00 0.00 N ATOM 289 CA GLN A 20 -1.379 35.707 -20.218 1.00 0.00 C ATOM 290 C GLN A 20 -0.833 37.084 -20.607 1.00 0.00 C ATOM 291 O GLN A 20 -0.434 37.867 -19.767 1.00 0.00 O ATOM 292 CB GLN A 20 -2.907 35.764 -20.154 1.00 0.00 C ATOM 293 CG GLN A 20 -3.452 34.399 -19.729 1.00 0.00 C ATOM 294 CD GLN A 20 -3.060 33.347 -20.768 1.00 0.00 C ATOM 295 OE1 GLN A 20 -3.133 33.592 -21.956 1.00 0.00 O ATOM 296 NE2 GLN A 20 -2.647 32.175 -20.368 1.00 0.00 N ATOM 0 H GLN A 20 -1.179 35.858 -18.098 1.00 0.00 H new ATOM 0 HA GLN A 20 -1.073 34.973 -20.964 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -3.223 36.530 -19.446 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -3.312 36.042 -21.127 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -3.055 34.125 -18.751 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -4.537 34.443 -19.632 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -2.586 31.969 -19.371 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -2.386 31.465 -21.053 1.00 0.00 H new ATOM 305 N LYS A 21 -0.817 37.383 -21.876 1.00 0.00 N ATOM 306 CA LYS A 21 -0.304 38.705 -22.334 1.00 0.00 C ATOM 307 C LYS A 21 -0.981 39.830 -21.544 1.00 0.00 C ATOM 308 O LYS A 21 -2.170 40.050 -21.665 1.00 0.00 O ATOM 309 CB LYS A 21 -0.627 38.877 -23.819 1.00 0.00 C ATOM 310 CG LYS A 21 0.223 37.906 -24.642 1.00 0.00 C ATOM 311 CD LYS A 21 0.169 38.307 -26.118 1.00 0.00 C ATOM 312 CE LYS A 21 0.590 39.771 -26.264 1.00 0.00 C ATOM 313 NZ LYS A 21 1.224 39.976 -27.597 1.00 0.00 N ATOM 0 H LYS A 21 -1.139 36.765 -22.620 1.00 0.00 H new ATOM 0 HA LYS A 21 0.773 38.749 -22.174 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -1.686 38.690 -23.996 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -0.429 39.903 -24.129 1.00 0.00 H new ATOM 0 HG2 LYS A 21 1.254 37.918 -24.288 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -0.145 36.888 -24.517 1.00 0.00 H new ATOM 0 HD2 LYS A 21 0.829 37.667 -26.704 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -0.839 38.167 -26.507 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -0.278 40.422 -26.158 1.00 0.00 H new ATOM 0 HE3 LYS A 21 1.289 40.040 -25.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 1.510 40.971 -27.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 2.061 39.365 -27.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 0.544 39.735 -28.346 1.00 0.00 H new ATOM 327 N GLY A 22 -0.242 40.553 -20.743 1.00 0.00 N ATOM 328 CA GLY A 22 -0.870 41.664 -19.971 1.00 0.00 C ATOM 329 C GLY A 22 -0.259 41.758 -18.568 1.00 0.00 C ATOM 330 O GLY A 22 -0.588 42.644 -17.805 1.00 0.00 O ATOM 0 H GLY A 22 0.758 40.424 -20.591 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -0.728 42.607 -20.499 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -1.945 41.499 -19.895 1.00 0.00 H new ATOM 334 N SER A 23 0.620 40.861 -18.214 1.00 0.00 N ATOM 335 CA SER A 23 1.224 40.929 -16.852 1.00 0.00 C ATOM 336 C SER A 23 1.968 42.259 -16.695 1.00 0.00 C ATOM 337 O SER A 23 2.617 42.728 -17.607 1.00 0.00 O ATOM 338 CB SER A 23 2.196 39.763 -16.658 1.00 0.00 C ATOM 339 OG SER A 23 1.513 38.536 -16.869 1.00 0.00 O ATOM 0 H SER A 23 0.944 40.092 -18.801 1.00 0.00 H new ATOM 0 HA SER A 23 0.437 40.862 -16.100 1.00 0.00 H new ATOM 0 HB2 SER A 23 3.030 39.851 -17.354 1.00 0.00 H new ATOM 0 HB3 SER A 23 2.616 39.789 -15.652 1.00 0.00 H new ATOM 0 HG SER A 23 0.778 38.456 -16.226 1.00 0.00 H new ATOM 345 N ASP A 24 1.875 42.873 -15.544 1.00 0.00 N ATOM 346 CA ASP A 24 2.573 44.176 -15.334 1.00 0.00 C ATOM 347 C ASP A 24 3.276 44.168 -13.973 1.00 0.00 C ATOM 348 O ASP A 24 3.175 43.220 -13.220 1.00 0.00 O ATOM 349 CB ASP A 24 1.554 45.319 -15.373 1.00 0.00 C ATOM 350 CG ASP A 24 0.254 44.832 -16.019 1.00 0.00 C ATOM 351 OD1 ASP A 24 -0.347 43.918 -15.478 1.00 0.00 O ATOM 352 OD2 ASP A 24 -0.118 45.381 -17.043 1.00 0.00 O ATOM 0 H ASP A 24 1.347 42.529 -14.742 1.00 0.00 H new ATOM 0 HA ASP A 24 3.310 44.320 -16.124 1.00 0.00 H new ATOM 0 HB2 ASP A 24 1.357 45.678 -14.363 1.00 0.00 H new ATOM 0 HB3 ASP A 24 1.958 46.160 -15.936 1.00 0.00 H new ATOM 357 N PRO A 25 4.005 45.252 -13.655 1.00 0.00 N ATOM 358 CA PRO A 25 4.730 45.373 -12.382 1.00 0.00 C ATOM 359 C PRO A 25 3.775 45.570 -11.199 1.00 0.00 C ATOM 360 O PRO A 25 4.039 45.138 -10.095 1.00 0.00 O ATOM 361 CB PRO A 25 5.588 46.621 -12.575 1.00 0.00 C ATOM 362 CG PRO A 25 4.866 47.424 -13.603 1.00 0.00 C ATOM 363 CD PRO A 25 4.180 46.439 -14.509 1.00 0.00 C ATOM 0 HA PRO A 25 5.305 44.476 -12.153 1.00 0.00 H new ATOM 0 HB2 PRO A 25 5.695 47.176 -11.643 1.00 0.00 H new ATOM 0 HB3 PRO A 25 6.593 46.362 -12.909 1.00 0.00 H new ATOM 0 HG2 PRO A 25 4.142 48.091 -13.136 1.00 0.00 H new ATOM 0 HG3 PRO A 25 5.560 48.050 -14.164 1.00 0.00 H new ATOM 0 HD2 PRO A 25 3.224 46.821 -14.867 1.00 0.00 H new ATOM 0 HD3 PRO A 25 4.783 46.215 -15.389 1.00 0.00 H new ATOM 371 N LYS A 26 2.661 46.214 -11.427 1.00 0.00 N ATOM 372 CA LYS A 26 1.683 46.433 -10.324 1.00 0.00 C ATOM 373 C LYS A 26 0.375 45.716 -10.667 1.00 0.00 C ATOM 374 O LYS A 26 -0.609 45.820 -9.962 1.00 0.00 O ATOM 375 CB LYS A 26 1.417 47.931 -10.160 1.00 0.00 C ATOM 376 CG LYS A 26 2.716 48.644 -9.779 1.00 0.00 C ATOM 377 CD LYS A 26 2.397 50.062 -9.303 1.00 0.00 C ATOM 378 CE LYS A 26 3.555 50.994 -9.664 1.00 0.00 C ATOM 379 NZ LYS A 26 4.741 50.658 -8.825 1.00 0.00 N ATOM 0 H LYS A 26 2.387 46.598 -12.331 1.00 0.00 H new ATOM 0 HA LYS A 26 2.088 46.038 -9.392 1.00 0.00 H new ATOM 0 HB2 LYS A 26 1.022 48.344 -11.088 1.00 0.00 H new ATOM 0 HB3 LYS A 26 0.662 48.095 -9.391 1.00 0.00 H new ATOM 0 HG2 LYS A 26 3.230 48.091 -8.992 1.00 0.00 H new ATOM 0 HG3 LYS A 26 3.389 48.679 -10.636 1.00 0.00 H new ATOM 0 HD2 LYS A 26 1.475 50.414 -9.766 1.00 0.00 H new ATOM 0 HD3 LYS A 26 2.234 50.067 -8.225 1.00 0.00 H new ATOM 0 HE2 LYS A 26 3.803 50.892 -10.721 1.00 0.00 H new ATOM 0 HE3 LYS A 26 3.264 52.032 -9.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 5.489 51.363 -8.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 4.468 50.661 -7.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 5.094 49.715 -9.085 1.00 0.00 H new ATOM 393 N LYS A 27 0.365 44.986 -11.748 1.00 0.00 N ATOM 394 CA LYS A 27 -0.865 44.251 -12.149 1.00 0.00 C ATOM 395 C LYS A 27 -0.460 42.887 -12.708 1.00 0.00 C ATOM 396 O LYS A 27 0.441 42.783 -13.516 1.00 0.00 O ATOM 397 CB LYS A 27 -1.610 45.044 -13.225 1.00 0.00 C ATOM 398 CG LYS A 27 -2.211 46.307 -12.601 1.00 0.00 C ATOM 399 CD LYS A 27 -3.078 47.024 -13.638 1.00 0.00 C ATOM 400 CE LYS A 27 -3.325 48.465 -13.186 1.00 0.00 C ATOM 401 NZ LYS A 27 -2.023 49.186 -13.092 1.00 0.00 N ATOM 0 H LYS A 27 1.162 44.867 -12.374 1.00 0.00 H new ATOM 0 HA LYS A 27 -1.518 44.121 -11.286 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -0.928 45.313 -14.032 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -2.398 44.432 -13.664 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -2.810 46.045 -11.729 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -1.417 46.968 -12.255 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -2.584 47.016 -14.610 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -4.027 46.501 -13.759 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -3.983 48.971 -13.892 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -3.828 48.473 -12.219 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -2.168 50.193 -13.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -1.641 49.089 -12.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -1.351 48.779 -13.773 1.00 0.00 H new ATOM 415 N LEU A 28 -1.108 41.838 -12.284 1.00 0.00 N ATOM 416 CA LEU A 28 -0.737 40.491 -12.798 1.00 0.00 C ATOM 417 C LEU A 28 -1.972 39.783 -13.354 1.00 0.00 C ATOM 418 O LEU A 28 -3.011 39.724 -12.726 1.00 0.00 O ATOM 419 CB LEU A 28 -0.139 39.657 -11.662 1.00 0.00 C ATOM 420 CG LEU A 28 1.185 39.044 -12.120 1.00 0.00 C ATOM 421 CD1 LEU A 28 2.115 38.884 -10.915 1.00 0.00 C ATOM 422 CD2 LEU A 28 0.925 37.672 -12.747 1.00 0.00 C ATOM 0 H LEU A 28 -1.873 41.854 -11.609 1.00 0.00 H new ATOM 0 HA LEU A 28 -0.002 40.605 -13.595 1.00 0.00 H new ATOM 0 HB2 LEU A 28 0.022 40.282 -10.784 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -0.834 38.870 -11.370 1.00 0.00 H new ATOM 0 HG LEU A 28 1.651 39.697 -12.857 1.00 0.00 H new ATOM 0 HD11 LEU A 28 3.059 38.447 -11.240 1.00 0.00 H new ATOM 0 HD12 LEU A 28 2.302 39.860 -10.467 1.00 0.00 H new ATOM 0 HD13 LEU A 28 1.647 38.231 -10.179 1.00 0.00 H new ATOM 0 HD21 LEU A 28 1.869 37.236 -13.073 1.00 0.00 H new ATOM 0 HD22 LEU A 28 0.459 37.018 -12.010 1.00 0.00 H new ATOM 0 HD23 LEU A 28 0.262 37.784 -13.605 1.00 0.00 H new ATOM 434 N VAL A 29 -1.852 39.230 -14.529 1.00 0.00 N ATOM 435 CA VAL A 29 -2.994 38.502 -15.144 1.00 0.00 C ATOM 436 C VAL A 29 -2.553 37.065 -15.415 1.00 0.00 C ATOM 437 O VAL A 29 -1.557 36.831 -16.070 1.00 0.00 O ATOM 438 CB VAL A 29 -3.387 39.178 -16.460 1.00 0.00 C ATOM 439 CG1 VAL A 29 -4.765 38.680 -16.898 1.00 0.00 C ATOM 440 CG2 VAL A 29 -3.433 40.695 -16.262 1.00 0.00 C ATOM 0 H VAL A 29 -1.003 39.252 -15.094 1.00 0.00 H new ATOM 0 HA VAL A 29 -3.854 38.513 -14.474 1.00 0.00 H new ATOM 0 HB VAL A 29 -2.651 38.934 -17.226 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -5.045 39.161 -17.835 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -4.733 37.600 -17.040 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -5.500 38.923 -16.131 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -3.713 41.176 -17.199 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -4.168 40.940 -15.495 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -2.451 41.051 -15.950 1.00 0.00 H new ATOM 450 N LEU A 30 -3.267 36.097 -14.911 1.00 0.00 N ATOM 451 CA LEU A 30 -2.852 34.686 -15.145 1.00 0.00 C ATOM 452 C LEU A 30 -4.078 33.812 -15.389 1.00 0.00 C ATOM 453 O LEU A 30 -5.097 33.957 -14.744 1.00 0.00 O ATOM 454 CB LEU A 30 -2.111 34.152 -13.914 1.00 0.00 C ATOM 455 CG LEU A 30 -0.998 35.119 -13.505 1.00 0.00 C ATOM 456 CD1 LEU A 30 -1.142 35.455 -12.018 1.00 0.00 C ATOM 457 CD2 LEU A 30 0.361 34.461 -13.748 1.00 0.00 C ATOM 0 H LEU A 30 -4.112 36.220 -14.353 1.00 0.00 H new ATOM 0 HA LEU A 30 -2.199 34.658 -16.017 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -2.810 34.021 -13.088 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -1.688 33.171 -14.132 1.00 0.00 H new ATOM 0 HG LEU A 30 -1.071 36.032 -14.095 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -0.351 36.144 -11.722 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -2.112 35.920 -11.842 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -1.066 34.541 -11.429 1.00 0.00 H new ATOM 0 HD21 LEU A 30 1.155 35.148 -13.457 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.435 33.549 -13.155 1.00 0.00 H new ATOM 0 HD23 LEU A 30 0.463 34.216 -14.805 1.00 0.00 H new ATOM 469 N ASP A 31 -3.977 32.883 -16.296 1.00 0.00 N ATOM 470 CA ASP A 31 -5.123 31.976 -16.557 1.00 0.00 C ATOM 471 C ASP A 31 -5.037 30.818 -15.566 1.00 0.00 C ATOM 472 O ASP A 31 -3.975 30.281 -15.323 1.00 0.00 O ATOM 473 CB ASP A 31 -5.048 31.439 -17.988 1.00 0.00 C ATOM 474 CG ASP A 31 -6.281 30.578 -18.273 1.00 0.00 C ATOM 475 OD1 ASP A 31 -7.137 30.500 -17.407 1.00 0.00 O ATOM 476 OD2 ASP A 31 -6.348 30.012 -19.352 1.00 0.00 O ATOM 0 H ASP A 31 -3.149 32.714 -16.867 1.00 0.00 H new ATOM 0 HA ASP A 31 -6.065 32.511 -16.439 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -4.997 32.266 -18.696 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -4.141 30.849 -18.120 1.00 0.00 H new ATOM 481 N ILE A 32 -6.133 30.431 -14.978 1.00 0.00 N ATOM 482 CA ILE A 32 -6.074 29.317 -13.996 1.00 0.00 C ATOM 483 C ILE A 32 -6.993 28.180 -14.432 1.00 0.00 C ATOM 484 O ILE A 32 -8.150 28.382 -14.743 1.00 0.00 O ATOM 485 CB ILE A 32 -6.507 29.822 -12.621 1.00 0.00 C ATOM 486 CG1 ILE A 32 -5.438 30.765 -12.066 1.00 0.00 C ATOM 487 CG2 ILE A 32 -6.687 28.633 -11.675 1.00 0.00 C ATOM 488 CD1 ILE A 32 -5.972 31.458 -10.810 1.00 0.00 C ATOM 0 H ILE A 32 -7.057 30.833 -15.133 1.00 0.00 H new ATOM 0 HA ILE A 32 -5.050 28.947 -13.945 1.00 0.00 H new ATOM 0 HB ILE A 32 -7.452 30.359 -12.709 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -4.533 30.206 -11.829 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -5.167 31.507 -12.817 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -6.996 28.992 -10.693 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -7.450 27.964 -12.073 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -5.744 28.095 -11.584 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -5.211 32.130 -10.414 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -6.865 32.030 -11.062 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -6.221 30.708 -10.059 1.00 0.00 H new ATOM 500 N LYS A 33 -6.488 26.980 -14.431 1.00 0.00 N ATOM 501 CA LYS A 33 -7.328 25.818 -14.817 1.00 0.00 C ATOM 502 C LYS A 33 -7.585 24.976 -13.568 1.00 0.00 C ATOM 503 O LYS A 33 -6.672 24.483 -12.938 1.00 0.00 O ATOM 504 CB LYS A 33 -6.610 24.978 -15.876 1.00 0.00 C ATOM 505 CG LYS A 33 -6.348 25.835 -17.117 1.00 0.00 C ATOM 506 CD LYS A 33 -5.641 24.991 -18.180 1.00 0.00 C ATOM 507 CE LYS A 33 -5.455 25.822 -19.451 1.00 0.00 C ATOM 508 NZ LYS A 33 -6.689 25.738 -20.284 1.00 0.00 N ATOM 0 H LYS A 33 -5.526 26.754 -14.178 1.00 0.00 H new ATOM 0 HA LYS A 33 -8.273 26.164 -15.237 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -5.669 24.599 -15.478 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -7.216 24.112 -16.141 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -7.288 26.221 -17.510 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -5.734 26.697 -16.854 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -4.673 24.655 -17.808 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -6.226 24.098 -18.399 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -5.248 26.860 -19.192 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -4.597 25.457 -20.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -6.564 26.303 -21.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -6.867 24.746 -20.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -7.498 26.106 -19.744 1.00 0.00 H new ATOM 522 N TYR A 34 -8.825 24.821 -13.204 1.00 0.00 N ATOM 523 CA TYR A 34 -9.157 24.027 -11.990 1.00 0.00 C ATOM 524 C TYR A 34 -10.105 22.889 -12.373 1.00 0.00 C ATOM 525 O TYR A 34 -11.217 23.113 -12.805 1.00 0.00 O ATOM 526 CB TYR A 34 -9.827 24.946 -10.968 1.00 0.00 C ATOM 527 CG TYR A 34 -10.041 24.203 -9.671 1.00 0.00 C ATOM 528 CD1 TYR A 34 -9.041 24.209 -8.691 1.00 0.00 C ATOM 529 CD2 TYR A 34 -11.238 23.513 -9.445 1.00 0.00 C ATOM 530 CE1 TYR A 34 -9.237 23.525 -7.486 1.00 0.00 C ATOM 531 CE2 TYR A 34 -11.434 22.828 -8.240 1.00 0.00 C ATOM 532 CZ TYR A 34 -10.433 22.835 -7.261 1.00 0.00 C ATOM 533 OH TYR A 34 -10.627 22.159 -6.072 1.00 0.00 O ATOM 0 H TYR A 34 -9.628 25.212 -13.697 1.00 0.00 H new ATOM 0 HA TYR A 34 -8.251 23.603 -11.558 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -9.207 25.826 -10.795 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -10.782 25.301 -11.356 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -8.118 24.742 -8.865 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -12.010 23.509 -10.200 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -8.465 23.530 -6.730 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -12.357 22.294 -8.066 1.00 0.00 H new ATOM 0 HH TYR A 34 -11.582 22.150 -5.853 1.00 0.00 H new ATOM 543 N THR A 35 -9.668 21.667 -12.226 1.00 0.00 N ATOM 544 CA THR A 35 -10.542 20.517 -12.593 1.00 0.00 C ATOM 545 C THR A 35 -10.796 19.645 -11.362 1.00 0.00 C ATOM 546 O THR A 35 -9.882 19.104 -10.771 1.00 0.00 O ATOM 547 CB THR A 35 -9.854 19.682 -13.675 1.00 0.00 C ATOM 548 OG1 THR A 35 -9.661 20.478 -14.836 1.00 0.00 O ATOM 549 CG2 THR A 35 -10.723 18.473 -14.021 1.00 0.00 C ATOM 0 H THR A 35 -8.746 21.416 -11.869 1.00 0.00 H new ATOM 0 HA THR A 35 -11.493 20.893 -12.969 1.00 0.00 H new ATOM 0 HB THR A 35 -8.888 19.337 -13.307 1.00 0.00 H new ATOM 0 HG1 THR A 35 -9.219 19.944 -15.529 1.00 0.00 H new ATOM 0 HG21 THR A 35 -10.231 17.880 -14.792 1.00 0.00 H new ATOM 0 HG22 THR A 35 -10.868 17.862 -13.130 1.00 0.00 H new ATOM 0 HG23 THR A 35 -11.691 18.814 -14.388 1.00 0.00 H new ATOM 557 N ARG A 36 -12.033 19.501 -10.975 1.00 0.00 N ATOM 558 CA ARG A 36 -12.353 18.661 -9.787 1.00 0.00 C ATOM 559 C ARG A 36 -13.586 17.808 -10.090 1.00 0.00 C ATOM 560 O ARG A 36 -14.537 18.270 -10.689 1.00 0.00 O ATOM 561 CB ARG A 36 -12.637 19.563 -8.585 1.00 0.00 C ATOM 562 CG ARG A 36 -12.677 18.716 -7.311 1.00 0.00 C ATOM 563 CD ARG A 36 -12.774 19.633 -6.091 1.00 0.00 C ATOM 564 NE ARG A 36 -13.486 18.923 -4.991 1.00 0.00 N ATOM 565 CZ ARG A 36 -12.821 18.509 -3.947 1.00 0.00 C ATOM 566 NH1 ARG A 36 -11.915 19.276 -3.405 1.00 0.00 N ATOM 567 NH2 ARG A 36 -13.064 17.330 -3.445 1.00 0.00 N ATOM 0 H ARG A 36 -12.838 19.930 -11.431 1.00 0.00 H new ATOM 0 HA ARG A 36 -11.507 18.012 -9.559 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -11.866 20.329 -8.501 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -13.587 20.080 -8.721 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -13.531 18.039 -7.339 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -11.782 18.098 -7.244 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -11.777 19.926 -5.763 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -13.306 20.548 -6.352 1.00 0.00 H new ATOM 0 HE ARG A 36 -14.491 18.761 -5.054 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -11.727 20.199 -3.797 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -11.395 18.953 -2.589 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -13.774 16.732 -3.868 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -12.544 17.006 -2.629 1.00 0.00 H new ATOM 581 N PRO A 37 -13.564 16.536 -9.668 1.00 0.00 N ATOM 582 CA PRO A 37 -14.676 15.605 -9.894 1.00 0.00 C ATOM 583 C PRO A 37 -15.909 15.968 -9.060 1.00 0.00 C ATOM 584 O PRO A 37 -15.966 15.708 -7.874 1.00 0.00 O ATOM 585 CB PRO A 37 -14.115 14.260 -9.437 1.00 0.00 C ATOM 586 CG PRO A 37 -13.045 14.611 -8.460 1.00 0.00 C ATOM 587 CD PRO A 37 -12.451 15.906 -8.937 1.00 0.00 C ATOM 0 HA PRO A 37 -15.009 15.615 -10.932 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -14.887 13.645 -8.975 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -13.714 13.692 -10.276 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -13.455 14.717 -7.455 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -12.287 13.829 -8.414 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -12.113 16.525 -8.106 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -11.588 15.740 -9.582 1.00 0.00 H new ATOM 595 N GLY A 38 -16.897 16.559 -9.673 1.00 0.00 N ATOM 596 CA GLY A 38 -18.127 16.930 -8.918 1.00 0.00 C ATOM 597 C GLY A 38 -17.936 18.299 -8.259 1.00 0.00 C ATOM 598 O GLY A 38 -18.796 18.779 -7.548 1.00 0.00 O ATOM 0 H GLY A 38 -16.906 16.801 -10.664 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -18.984 16.956 -9.591 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -18.340 16.177 -8.159 1.00 0.00 H new ATOM 602 N ASP A 39 -16.818 18.932 -8.488 1.00 0.00 N ATOM 603 CA ASP A 39 -16.583 20.267 -7.869 1.00 0.00 C ATOM 604 C ASP A 39 -15.943 21.205 -8.894 1.00 0.00 C ATOM 605 O ASP A 39 -15.634 20.815 -10.003 1.00 0.00 O ATOM 606 CB ASP A 39 -15.653 20.117 -6.665 1.00 0.00 C ATOM 607 CG ASP A 39 -16.485 19.855 -5.409 1.00 0.00 C ATOM 608 OD1 ASP A 39 -17.681 20.094 -5.453 1.00 0.00 O ATOM 609 OD2 ASP A 39 -15.913 19.421 -4.422 1.00 0.00 O ATOM 0 H ASP A 39 -16.060 18.584 -9.075 1.00 0.00 H new ATOM 0 HA ASP A 39 -17.536 20.684 -7.543 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -14.956 19.296 -6.830 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -15.057 21.020 -6.538 1.00 0.00 H new ATOM 614 N SER A 40 -15.745 22.444 -8.532 1.00 0.00 N ATOM 615 CA SER A 40 -15.129 23.413 -9.481 1.00 0.00 C ATOM 616 C SER A 40 -14.477 24.552 -8.695 1.00 0.00 C ATOM 617 O SER A 40 -14.746 24.746 -7.526 1.00 0.00 O ATOM 618 CB SER A 40 -16.214 23.985 -10.396 1.00 0.00 C ATOM 619 OG SER A 40 -16.510 23.050 -11.422 1.00 0.00 O ATOM 0 H SER A 40 -15.984 22.827 -7.617 1.00 0.00 H new ATOM 0 HA SER A 40 -14.374 22.905 -10.081 1.00 0.00 H new ATOM 0 HB2 SER A 40 -17.112 24.204 -9.819 1.00 0.00 H new ATOM 0 HB3 SER A 40 -15.878 24.926 -10.832 1.00 0.00 H new ATOM 0 HG SER A 40 -16.194 22.161 -11.156 1.00 0.00 H new ATOM 625 N LEU A 41 -13.624 25.310 -9.327 1.00 0.00 N ATOM 626 CA LEU A 41 -12.961 26.439 -8.615 1.00 0.00 C ATOM 627 C LEU A 41 -13.997 27.523 -8.315 1.00 0.00 C ATOM 628 O LEU A 41 -14.745 27.935 -9.179 1.00 0.00 O ATOM 629 CB LEU A 41 -11.857 27.016 -9.504 1.00 0.00 C ATOM 630 CG LEU A 41 -11.376 28.343 -8.923 1.00 0.00 C ATOM 631 CD1 LEU A 41 -10.905 28.129 -7.484 1.00 0.00 C ATOM 632 CD2 LEU A 41 -10.216 28.875 -9.767 1.00 0.00 C ATOM 0 H LEU A 41 -13.357 25.197 -10.305 1.00 0.00 H new ATOM 0 HA LEU A 41 -12.527 26.083 -7.681 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -11.026 26.314 -9.572 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -12.232 27.165 -10.517 1.00 0.00 H new ATOM 0 HG LEU A 41 -12.194 29.063 -8.933 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -10.561 29.077 -7.069 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -11.731 27.748 -6.884 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -10.086 27.410 -7.472 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -9.870 29.823 -9.354 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -9.398 28.155 -9.756 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -10.552 29.027 -10.793 1.00 0.00 H new ATOM 644 N ALA A 42 -14.059 27.983 -7.094 1.00 0.00 N ATOM 645 CA ALA A 42 -15.061 29.032 -6.746 1.00 0.00 C ATOM 646 C ALA A 42 -14.352 30.339 -6.385 1.00 0.00 C ATOM 647 O ALA A 42 -14.737 31.404 -6.825 1.00 0.00 O ATOM 648 CB ALA A 42 -15.887 28.563 -5.548 1.00 0.00 C ATOM 0 H ALA A 42 -13.462 27.679 -6.325 1.00 0.00 H new ATOM 0 HA ALA A 42 -15.711 29.202 -7.605 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -16.621 29.327 -5.290 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -16.402 27.636 -5.801 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -15.228 28.391 -4.697 1.00 0.00 H new ATOM 654 N GLU A 43 -13.326 30.273 -5.580 1.00 0.00 N ATOM 655 CA GLU A 43 -12.613 31.525 -5.192 1.00 0.00 C ATOM 656 C GLU A 43 -11.099 31.305 -5.226 1.00 0.00 C ATOM 657 O GLU A 43 -10.609 30.229 -4.949 1.00 0.00 O ATOM 658 CB GLU A 43 -13.035 31.934 -3.780 1.00 0.00 C ATOM 659 CG GLU A 43 -14.533 32.246 -3.766 1.00 0.00 C ATOM 660 CD GLU A 43 -14.883 33.000 -2.482 1.00 0.00 C ATOM 661 OE1 GLU A 43 -14.010 33.136 -1.640 1.00 0.00 O ATOM 662 OE2 GLU A 43 -16.020 33.429 -2.361 1.00 0.00 O ATOM 0 H GLU A 43 -12.953 29.414 -5.177 1.00 0.00 H new ATOM 0 HA GLU A 43 -12.873 32.313 -5.898 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -12.813 31.132 -3.076 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -12.468 32.807 -3.458 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -14.799 32.845 -4.637 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -15.109 31.322 -3.827 1.00 0.00 H new ATOM 669 N VAL A 44 -10.359 32.325 -5.564 1.00 0.00 N ATOM 670 CA VAL A 44 -8.876 32.195 -5.621 1.00 0.00 C ATOM 671 C VAL A 44 -8.234 33.458 -5.042 1.00 0.00 C ATOM 672 O VAL A 44 -8.652 34.561 -5.333 1.00 0.00 O ATOM 673 CB VAL A 44 -8.440 32.035 -7.078 1.00 0.00 C ATOM 674 CG1 VAL A 44 -6.912 32.007 -7.150 1.00 0.00 C ATOM 675 CG2 VAL A 44 -9.001 30.727 -7.638 1.00 0.00 C ATOM 0 H VAL A 44 -10.720 33.248 -5.804 1.00 0.00 H new ATOM 0 HA VAL A 44 -8.563 31.325 -5.044 1.00 0.00 H new ATOM 0 HB VAL A 44 -8.818 32.872 -7.665 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -6.599 31.893 -8.188 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -6.512 32.939 -6.750 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -6.535 31.169 -6.563 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.690 30.613 -8.677 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -8.624 29.889 -7.052 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -10.090 30.746 -7.585 1.00 0.00 H new ATOM 685 N GLU A 45 -7.218 33.317 -4.235 1.00 0.00 N ATOM 686 CA GLU A 45 -6.563 34.529 -3.666 1.00 0.00 C ATOM 687 C GLU A 45 -5.054 34.449 -3.901 1.00 0.00 C ATOM 688 O GLU A 45 -4.486 33.379 -3.993 1.00 0.00 O ATOM 689 CB GLU A 45 -6.853 34.625 -2.167 1.00 0.00 C ATOM 690 CG GLU A 45 -8.365 34.671 -1.940 1.00 0.00 C ATOM 691 CD GLU A 45 -8.652 35.088 -0.497 1.00 0.00 C ATOM 692 OE1 GLU A 45 -8.441 34.273 0.387 1.00 0.00 O ATOM 693 OE2 GLU A 45 -9.079 36.213 -0.300 1.00 0.00 O ATOM 0 H GLU A 45 -6.816 32.425 -3.947 1.00 0.00 H new ATOM 0 HA GLU A 45 -6.959 35.417 -4.158 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -6.423 33.769 -1.647 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -6.385 35.518 -1.752 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -8.826 35.376 -2.632 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -8.804 33.694 -2.141 1.00 0.00 H new ATOM 700 N LEU A 46 -4.404 35.575 -4.012 1.00 0.00 N ATOM 701 CA LEU A 46 -2.934 35.575 -4.256 1.00 0.00 C ATOM 702 C LEU A 46 -2.219 36.316 -3.124 1.00 0.00 C ATOM 703 O LEU A 46 -2.714 37.296 -2.603 1.00 0.00 O ATOM 704 CB LEU A 46 -2.648 36.291 -5.579 1.00 0.00 C ATOM 705 CG LEU A 46 -1.170 36.139 -5.939 1.00 0.00 C ATOM 706 CD1 LEU A 46 -0.963 36.507 -7.410 1.00 0.00 C ATOM 707 CD2 LEU A 46 -0.329 37.069 -5.060 1.00 0.00 C ATOM 0 H LEU A 46 -4.830 36.499 -3.944 1.00 0.00 H new ATOM 0 HA LEU A 46 -2.575 34.547 -4.299 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -3.270 35.874 -6.371 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -2.905 37.347 -5.495 1.00 0.00 H new ATOM 0 HG LEU A 46 -0.862 35.106 -5.774 1.00 0.00 H new ATOM 0 HD11 LEU A 46 0.091 36.399 -7.667 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -1.560 35.845 -8.038 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -1.272 37.539 -7.574 1.00 0.00 H new ATOM 0 HD21 LEU A 46 0.724 36.959 -5.318 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -0.637 38.102 -5.224 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -0.475 36.809 -4.012 1.00 0.00 H new ATOM 719 N ARG A 47 -1.053 35.866 -2.750 1.00 0.00 N ATOM 720 CA ARG A 47 -0.303 36.557 -1.663 1.00 0.00 C ATOM 721 C ARG A 47 1.104 36.889 -2.161 1.00 0.00 C ATOM 722 O ARG A 47 1.934 36.019 -2.340 1.00 0.00 O ATOM 723 CB ARG A 47 -0.212 35.649 -0.435 1.00 0.00 C ATOM 724 CG ARG A 47 0.155 36.487 0.790 1.00 0.00 C ATOM 725 CD ARG A 47 0.166 35.596 2.033 1.00 0.00 C ATOM 726 NE ARG A 47 1.350 34.692 1.988 1.00 0.00 N ATOM 727 CZ ARG A 47 1.934 34.327 3.095 1.00 0.00 C ATOM 728 NH1 ARG A 47 2.904 35.047 3.589 1.00 0.00 N ATOM 729 NH2 ARG A 47 1.547 33.243 3.709 1.00 0.00 N ATOM 0 H ARG A 47 -0.588 35.051 -3.149 1.00 0.00 H new ATOM 0 HA ARG A 47 -0.823 37.474 -1.387 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -1.164 35.143 -0.272 1.00 0.00 H new ATOM 0 HB3 ARG A 47 0.537 34.874 -0.597 1.00 0.00 H new ATOM 0 HG2 ARG A 47 1.134 36.946 0.650 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -0.562 37.298 0.917 1.00 0.00 H new ATOM 0 HD2 ARG A 47 0.198 36.210 2.933 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -0.751 35.009 2.080 1.00 0.00 H new ATOM 0 HE ARG A 47 1.703 34.359 1.091 1.00 0.00 H new ATOM 0 HH11 ARG A 47 3.205 35.895 3.109 1.00 0.00 H new ATOM 0 HH12 ARG A 47 3.361 34.762 4.455 1.00 0.00 H new ATOM 0 HH21 ARG A 47 0.788 32.682 3.323 1.00 0.00 H new ATOM 0 HH22 ARG A 47 2.003 32.957 4.575 1.00 0.00 H new ATOM 743 N GLN A 48 1.376 38.145 -2.393 1.00 0.00 N ATOM 744 CA GLN A 48 2.725 38.540 -2.886 1.00 0.00 C ATOM 745 C GLN A 48 3.804 37.949 -1.977 1.00 0.00 C ATOM 746 O GLN A 48 3.564 37.651 -0.823 1.00 0.00 O ATOM 747 CB GLN A 48 2.838 40.066 -2.886 1.00 0.00 C ATOM 748 CG GLN A 48 1.739 40.659 -3.769 1.00 0.00 C ATOM 749 CD GLN A 48 2.152 42.060 -4.225 1.00 0.00 C ATOM 750 OE1 GLN A 48 1.332 42.762 -4.957 1.00 0.00 O flip ATOM 751 NE2 GLN A 48 3.231 42.521 -3.910 1.00 0.00 N flip ATOM 0 H GLN A 48 0.720 38.915 -2.262 1.00 0.00 H new ATOM 0 HA GLN A 48 2.863 38.162 -3.899 1.00 0.00 H new ATOM 0 HB2 GLN A 48 2.748 40.448 -1.869 1.00 0.00 H new ATOM 0 HB3 GLN A 48 3.818 40.369 -3.254 1.00 0.00 H new ATOM 0 HG2 GLN A 48 1.568 40.019 -4.634 1.00 0.00 H new ATOM 0 HG3 GLN A 48 0.800 40.706 -3.217 1.00 0.00 H new ATOM 0 HE21 GLN A 48 3.873 41.972 -3.338 1.00 0.00 H new ATOM 0 HE22 GLN A 48 3.495 43.457 -4.218 1.00 0.00 H new ATOM 760 N HIS A 49 4.990 37.780 -2.491 1.00 0.00 N ATOM 761 CA HIS A 49 6.090 37.211 -1.664 1.00 0.00 C ATOM 762 C HIS A 49 6.499 38.220 -0.590 1.00 0.00 C ATOM 763 O HIS A 49 6.943 39.313 -0.885 1.00 0.00 O ATOM 764 CB HIS A 49 7.294 36.906 -2.555 1.00 0.00 C ATOM 765 CG HIS A 49 8.379 36.266 -1.732 1.00 0.00 C ATOM 766 ND1 HIS A 49 8.245 34.998 -1.190 1.00 0.00 N ATOM 767 CD2 HIS A 49 9.621 36.709 -1.350 1.00 0.00 C ATOM 768 CE1 HIS A 49 9.379 34.723 -0.518 1.00 0.00 C ATOM 769 NE2 HIS A 49 10.251 35.733 -0.584 1.00 0.00 N ATOM 0 H HIS A 49 5.246 38.012 -3.451 1.00 0.00 H new ATOM 0 HA HIS A 49 5.745 36.293 -1.189 1.00 0.00 H new ATOM 0 HB2 HIS A 49 6.999 36.242 -3.367 1.00 0.00 H new ATOM 0 HB3 HIS A 49 7.663 37.824 -3.012 1.00 0.00 H new ATOM 0 HD2 HIS A 49 10.045 37.669 -1.605 1.00 0.00 H new ATOM 0 HE1 HIS A 49 9.561 33.799 0.010 1.00 0.00 H new ATOM 0 HE2 HIS A 49 11.179 35.779 -0.163 1.00 0.00 H new ATOM 777 N GLY A 50 6.354 37.861 0.656 1.00 0.00 N ATOM 778 CA GLY A 50 6.734 38.796 1.752 1.00 0.00 C ATOM 779 C GLY A 50 5.479 39.471 2.306 1.00 0.00 C ATOM 780 O GLY A 50 5.550 40.324 3.167 1.00 0.00 O ATOM 0 H GLY A 50 5.988 36.959 0.963 1.00 0.00 H new ATOM 0 HA2 GLY A 50 7.248 38.253 2.545 1.00 0.00 H new ATOM 0 HA3 GLY A 50 7.429 39.548 1.378 1.00 0.00 H new ATOM 784 N SER A 51 4.328 39.097 1.817 1.00 0.00 N ATOM 785 CA SER A 51 3.070 39.719 2.317 1.00 0.00 C ATOM 786 C SER A 51 2.239 38.667 3.054 1.00 0.00 C ATOM 787 O SER A 51 2.334 37.486 2.785 1.00 0.00 O ATOM 788 CB SER A 51 2.267 40.267 1.136 1.00 0.00 C ATOM 789 OG SER A 51 1.421 41.316 1.585 1.00 0.00 O ATOM 0 H SER A 51 4.205 38.388 1.094 1.00 0.00 H new ATOM 0 HA SER A 51 3.314 40.533 2.999 1.00 0.00 H new ATOM 0 HB2 SER A 51 2.942 40.635 0.363 1.00 0.00 H new ATOM 0 HB3 SER A 51 1.672 39.472 0.687 1.00 0.00 H new ATOM 0 HG SER A 51 0.908 41.669 0.828 1.00 0.00 H new ATOM 795 N GLU A 52 1.423 39.087 3.982 1.00 0.00 N ATOM 796 CA GLU A 52 0.587 38.112 4.734 1.00 0.00 C ATOM 797 C GLU A 52 -0.891 38.373 4.435 1.00 0.00 C ATOM 798 O GLU A 52 -1.762 37.658 4.888 1.00 0.00 O ATOM 799 CB GLU A 52 0.840 38.274 6.234 1.00 0.00 C ATOM 800 CG GLU A 52 0.125 37.156 6.997 1.00 0.00 C ATOM 801 CD GLU A 52 0.318 37.359 8.501 1.00 0.00 C ATOM 802 OE1 GLU A 52 0.982 38.315 8.869 1.00 0.00 O ATOM 803 OE2 GLU A 52 -0.199 36.555 9.259 1.00 0.00 O ATOM 0 H GLU A 52 1.300 40.063 4.251 1.00 0.00 H new ATOM 0 HA GLU A 52 0.847 37.098 4.429 1.00 0.00 H new ATOM 0 HB2 GLU A 52 1.910 38.241 6.439 1.00 0.00 H new ATOM 0 HB3 GLU A 52 0.481 39.246 6.571 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -0.937 37.157 6.753 1.00 0.00 H new ATOM 0 HG3 GLU A 52 0.521 36.186 6.697 1.00 0.00 H new ATOM 810 N GLU A 53 -1.180 39.392 3.673 1.00 0.00 N ATOM 811 CA GLU A 53 -2.601 39.699 3.344 1.00 0.00 C ATOM 812 C GLU A 53 -2.948 39.107 1.976 1.00 0.00 C ATOM 813 O GLU A 53 -2.451 39.543 0.956 1.00 0.00 O ATOM 814 CB GLU A 53 -2.800 41.216 3.309 1.00 0.00 C ATOM 815 CG GLU A 53 -4.270 41.531 3.027 1.00 0.00 C ATOM 816 CD GLU A 53 -4.425 43.026 2.739 1.00 0.00 C ATOM 817 OE1 GLU A 53 -3.435 43.733 2.827 1.00 0.00 O ATOM 818 OE2 GLU A 53 -5.532 43.438 2.432 1.00 0.00 O ATOM 0 H GLU A 53 -0.493 40.026 3.264 1.00 0.00 H new ATOM 0 HA GLU A 53 -3.252 39.264 4.103 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -2.499 41.655 4.260 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -2.168 41.659 2.539 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -4.621 40.947 2.176 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -4.884 41.249 3.882 1.00 0.00 H new ATOM 825 N TRP A 54 -3.800 38.120 1.947 1.00 0.00 N ATOM 826 CA TRP A 54 -4.183 37.502 0.646 1.00 0.00 C ATOM 827 C TRP A 54 -5.123 38.442 -0.110 1.00 0.00 C ATOM 828 O TRP A 54 -6.111 38.908 0.422 1.00 0.00 O ATOM 829 CB TRP A 54 -4.894 36.172 0.903 1.00 0.00 C ATOM 830 CG TRP A 54 -3.898 35.146 1.340 1.00 0.00 C ATOM 831 CD1 TRP A 54 -3.477 34.964 2.612 1.00 0.00 C ATOM 832 CD2 TRP A 54 -3.195 34.160 0.531 1.00 0.00 C ATOM 833 NE1 TRP A 54 -2.559 33.928 2.635 1.00 0.00 N ATOM 834 CE2 TRP A 54 -2.354 33.401 1.376 1.00 0.00 C ATOM 835 CE3 TRP A 54 -3.208 33.854 -0.842 1.00 0.00 C ATOM 836 CZ2 TRP A 54 -1.551 32.374 0.877 1.00 0.00 C ATOM 837 CZ3 TRP A 54 -2.402 32.822 -1.347 1.00 0.00 C ATOM 838 CH2 TRP A 54 -1.576 32.083 -0.489 1.00 0.00 C ATOM 0 H TRP A 54 -4.248 37.714 2.769 1.00 0.00 H new ATOM 0 HA TRP A 54 -3.287 37.328 0.050 1.00 0.00 H new ATOM 0 HB2 TRP A 54 -5.659 36.299 1.669 1.00 0.00 H new ATOM 0 HB3 TRP A 54 -5.401 35.838 -0.002 1.00 0.00 H new ATOM 0 HD1 TRP A 54 -3.803 35.534 3.470 1.00 0.00 H new ATOM 0 HE1 TRP A 54 -2.092 33.595 3.478 1.00 0.00 H new ATOM 0 HE3 TRP A 54 -3.842 34.417 -1.511 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 -0.915 31.809 1.542 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 -2.418 32.596 -2.403 1.00 0.00 H new ATOM 0 HH2 TRP A 54 -0.959 31.289 -0.884 1.00 0.00 H new ATOM 849 N GLU A 55 -4.825 38.721 -1.350 1.00 0.00 N ATOM 850 CA GLU A 55 -5.702 39.628 -2.143 1.00 0.00 C ATOM 851 C GLU A 55 -6.582 38.795 -3.075 1.00 0.00 C ATOM 852 O GLU A 55 -6.130 37.852 -3.694 1.00 0.00 O ATOM 853 CB GLU A 55 -4.837 40.579 -2.973 1.00 0.00 C ATOM 854 CG GLU A 55 -4.696 41.913 -2.236 1.00 0.00 C ATOM 855 CD GLU A 55 -3.397 42.597 -2.663 1.00 0.00 C ATOM 856 OE1 GLU A 55 -2.462 41.891 -3.002 1.00 0.00 O ATOM 857 OE2 GLU A 55 -3.359 43.817 -2.645 1.00 0.00 O ATOM 0 H GLU A 55 -4.012 38.360 -1.848 1.00 0.00 H new ATOM 0 HA GLU A 55 -6.332 40.207 -1.468 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -3.854 40.139 -3.143 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -5.289 40.738 -3.952 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -5.548 42.555 -2.459 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -4.695 41.747 -1.159 1.00 0.00 H new ATOM 864 N PRO A 56 -7.870 39.155 -3.172 1.00 0.00 N ATOM 865 CA PRO A 56 -8.829 38.445 -4.025 1.00 0.00 C ATOM 866 C PRO A 56 -8.570 38.701 -5.514 1.00 0.00 C ATOM 867 O PRO A 56 -8.179 39.781 -5.909 1.00 0.00 O ATOM 868 CB PRO A 56 -10.176 39.043 -3.622 1.00 0.00 C ATOM 869 CG PRO A 56 -9.847 40.394 -3.085 1.00 0.00 C ATOM 870 CD PRO A 56 -8.489 40.282 -2.453 1.00 0.00 C ATOM 0 HA PRO A 56 -8.768 37.365 -3.894 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -10.850 39.110 -4.476 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -10.673 38.429 -2.871 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -9.844 41.138 -3.882 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -10.590 40.713 -2.354 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -7.913 41.200 -2.573 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -8.559 40.086 -1.383 1.00 0.00 H new ATOM 878 N LEU A 57 -8.792 37.717 -6.344 1.00 0.00 N ATOM 879 CA LEU A 57 -8.568 37.909 -7.804 1.00 0.00 C ATOM 880 C LEU A 57 -9.922 37.970 -8.510 1.00 0.00 C ATOM 881 O LEU A 57 -10.873 37.341 -8.089 1.00 0.00 O ATOM 882 CB LEU A 57 -7.765 36.728 -8.357 1.00 0.00 C ATOM 883 CG LEU A 57 -6.294 36.886 -7.974 1.00 0.00 C ATOM 884 CD1 LEU A 57 -6.115 36.558 -6.491 1.00 0.00 C ATOM 885 CD2 LEU A 57 -5.442 35.933 -8.815 1.00 0.00 C ATOM 0 H LEU A 57 -9.119 36.789 -6.073 1.00 0.00 H new ATOM 0 HA LEU A 57 -8.017 38.834 -7.973 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -8.156 35.791 -7.960 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -7.866 36.682 -9.441 1.00 0.00 H new ATOM 0 HG LEU A 57 -5.979 37.913 -8.159 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -5.066 36.671 -6.218 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -6.721 37.238 -5.892 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -6.430 35.531 -6.305 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -4.393 36.046 -8.542 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -5.756 34.906 -8.631 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -5.569 36.168 -9.872 1.00 0.00 H new ATOM 897 N THR A 58 -10.030 38.714 -9.576 1.00 0.00 N ATOM 898 CA THR A 58 -11.342 38.784 -10.279 1.00 0.00 C ATOM 899 C THR A 58 -11.293 37.902 -11.529 1.00 0.00 C ATOM 900 O THR A 58 -10.401 38.019 -12.347 1.00 0.00 O ATOM 901 CB THR A 58 -11.645 40.231 -10.677 1.00 0.00 C ATOM 902 OG1 THR A 58 -11.751 41.029 -9.507 1.00 0.00 O ATOM 903 CG2 THR A 58 -12.962 40.281 -11.453 1.00 0.00 C ATOM 0 H THR A 58 -9.279 39.269 -9.986 1.00 0.00 H new ATOM 0 HA THR A 58 -12.129 38.430 -9.613 1.00 0.00 H new ATOM 0 HB THR A 58 -10.841 40.613 -11.305 1.00 0.00 H new ATOM 0 HG1 THR A 58 -11.943 41.956 -9.760 1.00 0.00 H new ATOM 0 HG21 THR A 58 -13.178 41.311 -11.737 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.879 39.667 -12.350 1.00 0.00 H new ATOM 0 HG23 THR A 58 -13.768 39.900 -10.826 1.00 0.00 H new ATOM 911 N LYS A 59 -12.237 37.013 -11.679 1.00 0.00 N ATOM 912 CA LYS A 59 -12.232 36.121 -12.871 1.00 0.00 C ATOM 913 C LYS A 59 -12.623 36.932 -14.110 1.00 0.00 C ATOM 914 O LYS A 59 -13.756 37.347 -14.253 1.00 0.00 O ATOM 915 CB LYS A 59 -13.238 34.988 -12.659 1.00 0.00 C ATOM 916 CG LYS A 59 -12.890 33.815 -13.576 1.00 0.00 C ATOM 917 CD LYS A 59 -13.670 32.574 -13.134 1.00 0.00 C ATOM 918 CE LYS A 59 -13.454 31.446 -14.146 1.00 0.00 C ATOM 919 NZ LYS A 59 -14.261 31.715 -15.369 1.00 0.00 N ATOM 0 H LYS A 59 -13.009 36.867 -11.029 1.00 0.00 H new ATOM 0 HA LYS A 59 -11.237 35.699 -13.012 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -13.224 34.665 -11.618 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -14.248 35.340 -12.870 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -13.134 34.062 -14.609 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -11.819 33.617 -13.540 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -13.339 32.257 -12.145 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -14.732 32.808 -13.056 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -12.397 31.371 -14.404 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -13.744 30.490 -13.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -13.818 31.249 -16.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -15.224 31.344 -15.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -14.305 32.740 -15.537 1.00 0.00 H new ATOM 933 N LYS A 60 -11.702 37.172 -15.005 1.00 0.00 N ATOM 934 CA LYS A 60 -12.048 37.966 -16.217 1.00 0.00 C ATOM 935 C LYS A 60 -11.838 37.117 -17.474 1.00 0.00 C ATOM 936 O LYS A 60 -10.886 36.373 -17.578 1.00 0.00 O ATOM 937 CB LYS A 60 -11.151 39.202 -16.290 1.00 0.00 C ATOM 938 CG LYS A 60 -11.521 40.172 -15.168 1.00 0.00 C ATOM 939 CD LYS A 60 -13.003 40.535 -15.275 1.00 0.00 C ATOM 940 CE LYS A 60 -13.320 41.676 -14.305 1.00 0.00 C ATOM 941 NZ LYS A 60 -14.575 41.365 -13.565 1.00 0.00 N ATOM 0 H LYS A 60 -10.734 36.855 -14.950 1.00 0.00 H new ATOM 0 HA LYS A 60 -13.093 38.271 -16.157 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -10.105 38.910 -16.201 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -11.265 39.690 -17.258 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -11.316 39.718 -14.198 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -10.910 41.072 -15.235 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -13.242 40.834 -16.296 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -13.619 39.666 -15.045 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -12.496 41.811 -13.604 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -13.430 42.612 -14.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -14.633 41.960 -12.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -15.395 41.555 -14.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -14.575 40.363 -13.287 1.00 0.00 H new ATOM 955 N GLY A 61 -12.711 37.231 -18.435 1.00 0.00 N ATOM 956 CA GLY A 61 -12.550 36.439 -19.689 1.00 0.00 C ATOM 957 C GLY A 61 -12.112 35.006 -19.363 1.00 0.00 C ATOM 958 O GLY A 61 -11.410 34.378 -20.130 1.00 0.00 O ATOM 0 H GLY A 61 -13.530 37.838 -18.408 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -13.491 36.422 -20.240 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -11.811 36.914 -20.335 1.00 0.00 H new ATOM 962 N ASN A 62 -12.529 34.481 -18.242 1.00 0.00 N ATOM 963 CA ASN A 62 -12.150 33.082 -17.876 1.00 0.00 C ATOM 964 C ASN A 62 -10.756 33.048 -17.239 1.00 0.00 C ATOM 965 O ASN A 62 -10.165 31.999 -17.085 1.00 0.00 O ATOM 966 CB ASN A 62 -12.155 32.204 -19.130 1.00 0.00 C ATOM 967 CG ASN A 62 -13.342 32.586 -20.018 1.00 0.00 C ATOM 968 OD1 ASN A 62 -14.472 32.595 -19.572 1.00 0.00 O ATOM 969 ND2 ASN A 62 -13.130 32.905 -21.265 1.00 0.00 N ATOM 0 H ASN A 62 -13.118 34.961 -17.561 1.00 0.00 H new ATOM 0 HA ASN A 62 -12.875 32.704 -17.155 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -11.222 32.330 -19.679 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -12.220 31.153 -18.850 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -13.913 33.162 -21.866 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -12.181 32.897 -21.639 1.00 0.00 H new ATOM 976 N VAL A 63 -10.230 34.178 -16.856 1.00 0.00 N ATOM 977 CA VAL A 63 -8.881 34.192 -16.217 1.00 0.00 C ATOM 978 C VAL A 63 -8.967 34.969 -14.905 1.00 0.00 C ATOM 979 O VAL A 63 -9.983 35.553 -14.592 1.00 0.00 O ATOM 980 CB VAL A 63 -7.864 34.861 -17.147 1.00 0.00 C ATOM 981 CG1 VAL A 63 -7.653 33.989 -18.385 1.00 0.00 C ATOM 982 CG2 VAL A 63 -8.382 36.236 -17.573 1.00 0.00 C ATOM 0 H VAL A 63 -10.673 35.091 -16.957 1.00 0.00 H new ATOM 0 HA VAL A 63 -8.557 33.169 -16.025 1.00 0.00 H new ATOM 0 HB VAL A 63 -6.917 34.980 -16.620 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -6.929 34.465 -19.046 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -7.279 33.011 -18.082 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -8.600 33.868 -18.911 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -7.656 36.709 -18.234 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -9.330 36.121 -18.098 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -8.529 36.859 -16.691 1.00 0.00 H new ATOM 992 N TRP A 64 -7.918 34.983 -14.129 1.00 0.00 N ATOM 993 CA TRP A 64 -7.973 35.728 -12.841 1.00 0.00 C ATOM 994 C TRP A 64 -6.898 36.814 -12.829 1.00 0.00 C ATOM 995 O TRP A 64 -5.728 36.548 -13.028 1.00 0.00 O ATOM 996 CB TRP A 64 -7.744 34.762 -11.677 1.00 0.00 C ATOM 997 CG TRP A 64 -8.867 33.777 -11.622 1.00 0.00 C ATOM 998 CD1 TRP A 64 -9.029 32.736 -12.470 1.00 0.00 C ATOM 999 CD2 TRP A 64 -9.984 33.721 -10.688 1.00 0.00 C ATOM 1000 NE1 TRP A 64 -10.174 32.045 -12.116 1.00 0.00 N ATOM 1001 CE2 TRP A 64 -10.798 32.614 -11.024 1.00 0.00 C ATOM 1002 CE3 TRP A 64 -10.367 34.517 -9.591 1.00 0.00 C ATOM 1003 CZ2 TRP A 64 -11.949 32.304 -10.300 1.00 0.00 C ATOM 1004 CZ3 TRP A 64 -11.526 34.208 -8.860 1.00 0.00 C ATOM 1005 CH2 TRP A 64 -12.315 33.104 -9.215 1.00 0.00 C ATOM 0 H TRP A 64 -7.034 34.516 -14.329 1.00 0.00 H new ATOM 0 HA TRP A 64 -8.954 36.192 -12.735 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -6.795 34.241 -11.803 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -7.683 35.313 -10.739 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -8.372 32.485 -13.290 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -10.516 31.216 -12.603 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -9.766 35.370 -9.310 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -12.553 31.452 -10.576 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -11.811 34.824 -8.020 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -13.205 32.872 -8.649 1.00 0.00 H new ATOM 1016 N GLU A 65 -7.288 38.037 -12.597 1.00 0.00 N ATOM 1017 CA GLU A 65 -6.293 39.142 -12.572 1.00 0.00 C ATOM 1018 C GLU A 65 -6.206 39.718 -11.159 1.00 0.00 C ATOM 1019 O GLU A 65 -7.165 39.706 -10.410 1.00 0.00 O ATOM 1020 CB GLU A 65 -6.725 40.240 -13.546 1.00 0.00 C ATOM 1021 CG GLU A 65 -5.809 41.455 -13.384 1.00 0.00 C ATOM 1022 CD GLU A 65 -6.134 42.486 -14.467 1.00 0.00 C ATOM 1023 OE1 GLU A 65 -7.130 42.307 -15.149 1.00 0.00 O ATOM 1024 OE2 GLU A 65 -5.381 43.437 -14.596 1.00 0.00 O ATOM 0 H GLU A 65 -8.253 38.317 -12.424 1.00 0.00 H new ATOM 0 HA GLU A 65 -5.317 38.758 -12.868 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -6.679 39.871 -14.571 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -7.760 40.524 -13.355 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -5.942 41.895 -12.396 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -4.765 41.150 -13.459 1.00 0.00 H new ATOM 1031 N VAL A 66 -5.061 40.224 -10.792 1.00 0.00 N ATOM 1032 CA VAL A 66 -4.900 40.806 -9.432 1.00 0.00 C ATOM 1033 C VAL A 66 -4.113 42.113 -9.533 1.00 0.00 C ATOM 1034 O VAL A 66 -3.103 42.188 -10.204 1.00 0.00 O ATOM 1035 CB VAL A 66 -4.136 39.822 -8.543 1.00 0.00 C ATOM 1036 CG1 VAL A 66 -2.674 39.763 -8.988 1.00 0.00 C ATOM 1037 CG2 VAL A 66 -4.207 40.287 -7.088 1.00 0.00 C ATOM 0 H VAL A 66 -4.227 40.259 -11.379 1.00 0.00 H new ATOM 0 HA VAL A 66 -5.881 41.000 -8.999 1.00 0.00 H new ATOM 0 HB VAL A 66 -4.583 38.832 -8.630 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -2.129 39.062 -8.355 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -2.622 39.431 -10.025 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.227 40.753 -8.901 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -3.663 39.586 -6.455 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -3.760 41.277 -7.000 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -5.249 40.330 -6.770 1.00 0.00 H new ATOM 1047 N LYS A 67 -4.563 43.144 -8.873 1.00 0.00 N ATOM 1048 CA LYS A 67 -3.832 44.440 -8.938 1.00 0.00 C ATOM 1049 C LYS A 67 -3.395 44.849 -7.531 1.00 0.00 C ATOM 1050 O LYS A 67 -4.168 44.826 -6.594 1.00 0.00 O ATOM 1051 CB LYS A 67 -4.741 45.518 -9.531 1.00 0.00 C ATOM 1052 CG LYS A 67 -4.110 46.895 -9.318 1.00 0.00 C ATOM 1053 CD LYS A 67 -5.100 47.980 -9.745 1.00 0.00 C ATOM 1054 CE LYS A 67 -4.425 49.350 -9.653 1.00 0.00 C ATOM 1055 NZ LYS A 67 -5.142 50.190 -8.652 1.00 0.00 N ATOM 0 H LYS A 67 -5.402 43.145 -8.293 1.00 0.00 H new ATOM 0 HA LYS A 67 -2.953 44.328 -9.572 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -4.891 45.336 -10.595 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -5.723 45.480 -9.059 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -3.841 47.025 -8.270 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -3.190 46.979 -9.896 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -5.439 47.797 -10.765 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -5.983 47.954 -9.106 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -3.380 49.234 -9.365 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -4.435 49.838 -10.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -4.684 51.122 -8.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -6.132 50.310 -8.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -5.111 49.725 -7.722 1.00 0.00 H new ATOM 1069 N SER A 68 -2.152 45.219 -7.379 1.00 0.00 N ATOM 1070 CA SER A 68 -1.646 45.627 -6.040 1.00 0.00 C ATOM 1071 C SER A 68 -1.193 47.087 -6.088 1.00 0.00 C ATOM 1072 O SER A 68 -0.883 47.615 -7.138 1.00 0.00 O ATOM 1073 CB SER A 68 -0.453 44.745 -5.664 1.00 0.00 C ATOM 1074 OG SER A 68 -0.090 44.989 -4.314 1.00 0.00 O ATOM 0 H SER A 68 -1.463 45.256 -8.130 1.00 0.00 H new ATOM 0 HA SER A 68 -2.439 45.515 -5.301 1.00 0.00 H new ATOM 0 HB2 SER A 68 -0.708 43.694 -5.799 1.00 0.00 H new ATOM 0 HB3 SER A 68 0.390 44.956 -6.322 1.00 0.00 H new ATOM 0 HG SER A 68 0.533 44.295 -4.012 1.00 0.00 H new ATOM 1080 N SER A 69 -1.144 47.741 -4.962 1.00 0.00 N ATOM 1081 CA SER A 69 -0.701 49.161 -4.950 1.00 0.00 C ATOM 1082 C SER A 69 0.827 49.208 -4.909 1.00 0.00 C ATOM 1083 O SER A 69 1.426 50.258 -4.788 1.00 0.00 O ATOM 1084 CB SER A 69 -1.270 49.865 -3.717 1.00 0.00 C ATOM 1085 OG SER A 69 -0.924 51.242 -3.755 1.00 0.00 O ATOM 0 H SER A 69 -1.391 47.354 -4.051 1.00 0.00 H new ATOM 0 HA SER A 69 -1.059 49.665 -5.847 1.00 0.00 H new ATOM 0 HB2 SER A 69 -2.354 49.752 -3.689 1.00 0.00 H new ATOM 0 HB3 SER A 69 -0.878 49.406 -2.810 1.00 0.00 H new ATOM 0 HG SER A 69 -0.012 51.341 -4.101 1.00 0.00 H new ATOM 1091 N LYS A 70 1.463 48.072 -5.010 1.00 0.00 N ATOM 1092 CA LYS A 70 2.952 48.037 -4.979 1.00 0.00 C ATOM 1093 C LYS A 70 3.454 47.035 -6.021 1.00 0.00 C ATOM 1094 O LYS A 70 2.677 46.363 -6.670 1.00 0.00 O ATOM 1095 CB LYS A 70 3.420 47.605 -3.587 1.00 0.00 C ATOM 1096 CG LYS A 70 4.032 48.804 -2.860 1.00 0.00 C ATOM 1097 CD LYS A 70 4.157 48.486 -1.369 1.00 0.00 C ATOM 1098 CE LYS A 70 5.617 48.167 -1.037 1.00 0.00 C ATOM 1099 NZ LYS A 70 6.208 49.296 -0.265 1.00 0.00 N ATOM 0 H LYS A 70 1.012 47.163 -5.113 1.00 0.00 H new ATOM 0 HA LYS A 70 3.348 49.027 -5.204 1.00 0.00 H new ATOM 0 HB2 LYS A 70 2.580 47.210 -3.016 1.00 0.00 H new ATOM 0 HB3 LYS A 70 4.154 46.804 -3.671 1.00 0.00 H new ATOM 0 HG2 LYS A 70 5.012 49.034 -3.277 1.00 0.00 H new ATOM 0 HG3 LYS A 70 3.409 49.687 -3.004 1.00 0.00 H new ATOM 0 HD2 LYS A 70 3.815 49.334 -0.775 1.00 0.00 H new ATOM 0 HD3 LYS A 70 3.521 47.639 -1.112 1.00 0.00 H new ATOM 0 HE2 LYS A 70 5.677 47.246 -0.458 1.00 0.00 H new ATOM 0 HE3 LYS A 70 6.183 48.004 -1.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 7.200 49.080 -0.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 6.164 50.166 -0.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 5.673 49.431 0.617 1.00 0.00 H new ATOM 1113 N PRO A 71 4.782 46.934 -6.183 1.00 0.00 N ATOM 1114 CA PRO A 71 5.391 46.010 -7.148 1.00 0.00 C ATOM 1115 C PRO A 71 5.230 44.549 -6.716 1.00 0.00 C ATOM 1116 O PRO A 71 5.589 44.173 -5.618 1.00 0.00 O ATOM 1117 CB PRO A 71 6.868 46.402 -7.136 1.00 0.00 C ATOM 1118 CG PRO A 71 7.081 47.024 -5.798 1.00 0.00 C ATOM 1119 CD PRO A 71 5.792 47.708 -5.440 1.00 0.00 C ATOM 0 HA PRO A 71 4.927 46.080 -8.132 1.00 0.00 H new ATOM 0 HB2 PRO A 71 7.510 45.532 -7.276 1.00 0.00 H new ATOM 0 HB3 PRO A 71 7.099 47.101 -7.940 1.00 0.00 H new ATOM 0 HG2 PRO A 71 7.340 46.269 -5.055 1.00 0.00 H new ATOM 0 HG3 PRO A 71 7.904 47.738 -5.828 1.00 0.00 H new ATOM 0 HD2 PRO A 71 5.608 47.683 -4.366 1.00 0.00 H new ATOM 0 HD3 PRO A 71 5.796 48.756 -5.739 1.00 0.00 H new ATOM 1127 N LEU A 72 4.691 43.724 -7.571 1.00 0.00 N ATOM 1128 CA LEU A 72 4.503 42.290 -7.211 1.00 0.00 C ATOM 1129 C LEU A 72 5.859 41.649 -6.913 1.00 0.00 C ATOM 1130 O LEU A 72 6.830 41.866 -7.609 1.00 0.00 O ATOM 1131 CB LEU A 72 3.834 41.555 -8.374 1.00 0.00 C ATOM 1132 CG LEU A 72 2.586 42.324 -8.813 1.00 0.00 C ATOM 1133 CD1 LEU A 72 2.461 42.265 -10.337 1.00 0.00 C ATOM 1134 CD2 LEU A 72 1.347 41.692 -8.176 1.00 0.00 C ATOM 0 H LEU A 72 4.372 43.981 -8.505 1.00 0.00 H new ATOM 0 HA LEU A 72 3.871 42.221 -6.325 1.00 0.00 H new ATOM 0 HB2 LEU A 72 4.530 41.463 -9.208 1.00 0.00 H new ATOM 0 HB3 LEU A 72 3.563 40.543 -8.071 1.00 0.00 H new ATOM 0 HG LEU A 72 2.669 43.363 -8.494 1.00 0.00 H new ATOM 0 HD11 LEU A 72 1.572 42.813 -10.651 1.00 0.00 H new ATOM 0 HD12 LEU A 72 3.344 42.715 -10.792 1.00 0.00 H new ATOM 0 HD13 LEU A 72 2.378 41.226 -10.655 1.00 0.00 H new ATOM 0 HD21 LEU A 72 0.458 42.240 -8.488 1.00 0.00 H new ATOM 0 HD22 LEU A 72 1.264 40.653 -8.495 1.00 0.00 H new ATOM 0 HD23 LEU A 72 1.435 41.733 -7.090 1.00 0.00 H new ATOM 1146 N VAL A 73 5.928 40.861 -5.874 1.00 0.00 N ATOM 1147 CA VAL A 73 7.214 40.200 -5.514 1.00 0.00 C ATOM 1148 C VAL A 73 7.007 38.686 -5.445 1.00 0.00 C ATOM 1149 O VAL A 73 6.148 38.198 -4.737 1.00 0.00 O ATOM 1150 CB VAL A 73 7.681 40.711 -4.151 1.00 0.00 C ATOM 1151 CG1 VAL A 73 8.984 40.010 -3.761 1.00 0.00 C ATOM 1152 CG2 VAL A 73 7.918 42.221 -4.225 1.00 0.00 C ATOM 0 H VAL A 73 5.145 40.646 -5.257 1.00 0.00 H new ATOM 0 HA VAL A 73 7.966 40.430 -6.269 1.00 0.00 H new ATOM 0 HB VAL A 73 6.916 40.499 -3.404 1.00 0.00 H new ATOM 0 HG11 VAL A 73 9.317 40.375 -2.789 1.00 0.00 H new ATOM 0 HG12 VAL A 73 8.816 38.934 -3.707 1.00 0.00 H new ATOM 0 HG13 VAL A 73 9.749 40.221 -4.509 1.00 0.00 H new ATOM 0 HG21 VAL A 73 8.251 42.585 -3.253 1.00 0.00 H new ATOM 0 HG22 VAL A 73 8.682 42.433 -4.973 1.00 0.00 H new ATOM 0 HG23 VAL A 73 6.990 42.722 -4.502 1.00 0.00 H new ATOM 1162 N GLY A 74 7.791 37.937 -6.171 1.00 0.00 N ATOM 1163 CA GLY A 74 7.641 36.453 -6.144 1.00 0.00 C ATOM 1164 C GLY A 74 8.620 35.863 -5.126 1.00 0.00 C ATOM 1165 O GLY A 74 9.500 36.540 -4.635 1.00 0.00 O ATOM 0 H GLY A 74 8.529 38.288 -6.782 1.00 0.00 H new ATOM 0 HA2 GLY A 74 6.618 36.184 -5.880 1.00 0.00 H new ATOM 0 HA3 GLY A 74 7.834 36.039 -7.134 1.00 0.00 H new ATOM 1169 N PRO A 75 8.459 34.569 -4.805 1.00 0.00 N ATOM 1170 CA PRO A 75 7.403 33.730 -5.386 1.00 0.00 C ATOM 1171 C PRO A 75 6.010 34.148 -4.908 1.00 0.00 C ATOM 1172 O PRO A 75 5.829 34.606 -3.797 1.00 0.00 O ATOM 1173 CB PRO A 75 7.738 32.328 -4.879 1.00 0.00 C ATOM 1174 CG PRO A 75 8.515 32.559 -3.627 1.00 0.00 C ATOM 1175 CD PRO A 75 9.295 33.824 -3.848 1.00 0.00 C ATOM 0 HA PRO A 75 7.373 33.806 -6.473 1.00 0.00 H new ATOM 0 HB2 PRO A 75 6.835 31.750 -4.684 1.00 0.00 H new ATOM 0 HB3 PRO A 75 8.322 31.770 -5.611 1.00 0.00 H new ATOM 0 HG2 PRO A 75 7.851 32.656 -2.768 1.00 0.00 H new ATOM 0 HG3 PRO A 75 9.181 31.721 -3.422 1.00 0.00 H new ATOM 0 HD2 PRO A 75 9.436 34.378 -2.920 1.00 0.00 H new ATOM 0 HD3 PRO A 75 10.287 33.621 -4.252 1.00 0.00 H new ATOM 1183 N PHE A 76 5.027 34.002 -5.754 1.00 0.00 N ATOM 1184 CA PHE A 76 3.640 34.397 -5.378 1.00 0.00 C ATOM 1185 C PHE A 76 2.897 33.210 -4.763 1.00 0.00 C ATOM 1186 O PHE A 76 3.135 32.066 -5.107 1.00 0.00 O ATOM 1187 CB PHE A 76 2.899 34.852 -6.637 1.00 0.00 C ATOM 1188 CG PHE A 76 3.564 36.088 -7.191 1.00 0.00 C ATOM 1189 CD1 PHE A 76 3.360 37.328 -6.575 1.00 0.00 C ATOM 1190 CD2 PHE A 76 4.385 35.995 -8.321 1.00 0.00 C ATOM 1191 CE1 PHE A 76 3.979 38.475 -7.088 1.00 0.00 C ATOM 1192 CE2 PHE A 76 5.002 37.141 -8.836 1.00 0.00 C ATOM 1193 CZ PHE A 76 4.799 38.381 -8.218 1.00 0.00 C ATOM 0 H PHE A 76 5.126 33.623 -6.696 1.00 0.00 H new ATOM 0 HA PHE A 76 3.683 35.205 -4.647 1.00 0.00 H new ATOM 0 HB2 PHE A 76 2.905 34.057 -7.383 1.00 0.00 H new ATOM 0 HB3 PHE A 76 1.855 35.061 -6.402 1.00 0.00 H new ATOM 0 HD1 PHE A 76 2.725 37.400 -5.704 1.00 0.00 H new ATOM 0 HD2 PHE A 76 4.543 35.038 -8.796 1.00 0.00 H new ATOM 0 HE1 PHE A 76 3.823 39.432 -6.612 1.00 0.00 H new ATOM 0 HE2 PHE A 76 5.634 37.069 -9.709 1.00 0.00 H new ATOM 0 HZ PHE A 76 5.276 39.266 -8.614 1.00 0.00 H new ATOM 1203 N ASN A 77 1.983 33.473 -3.870 1.00 0.00 N ATOM 1204 CA ASN A 77 1.203 32.368 -3.246 1.00 0.00 C ATOM 1205 C ASN A 77 -0.251 32.469 -3.718 1.00 0.00 C ATOM 1206 O ASN A 77 -0.771 33.550 -3.909 1.00 0.00 O ATOM 1207 CB ASN A 77 1.256 32.495 -1.721 1.00 0.00 C ATOM 1208 CG ASN A 77 2.662 32.915 -1.290 1.00 0.00 C ATOM 1209 OD1 ASN A 77 3.524 32.081 -1.090 1.00 0.00 O ATOM 1210 ND2 ASN A 77 2.934 34.182 -1.137 1.00 0.00 N ATOM 0 H ASN A 77 1.742 34.409 -3.545 1.00 0.00 H new ATOM 0 HA ASN A 77 1.625 31.406 -3.536 1.00 0.00 H new ATOM 0 HB2 ASN A 77 0.526 33.230 -1.382 1.00 0.00 H new ATOM 0 HB3 ASN A 77 0.991 31.545 -1.257 1.00 0.00 H new ATOM 0 HD21 ASN A 77 3.869 34.472 -0.850 1.00 0.00 H new ATOM 0 HD22 ASN A 77 2.212 34.883 -1.304 1.00 0.00 H new ATOM 1217 N PHE A 78 -0.913 31.362 -3.916 1.00 0.00 N ATOM 1218 CA PHE A 78 -2.328 31.426 -4.385 1.00 0.00 C ATOM 1219 C PHE A 78 -3.190 30.436 -3.596 1.00 0.00 C ATOM 1220 O PHE A 78 -2.899 29.258 -3.538 1.00 0.00 O ATOM 1221 CB PHE A 78 -2.393 31.064 -5.870 1.00 0.00 C ATOM 1222 CG PHE A 78 -1.508 31.993 -6.668 1.00 0.00 C ATOM 1223 CD1 PHE A 78 -0.115 31.879 -6.584 1.00 0.00 C ATOM 1224 CD2 PHE A 78 -2.083 32.962 -7.499 1.00 0.00 C ATOM 1225 CE1 PHE A 78 0.702 32.735 -7.331 1.00 0.00 C ATOM 1226 CE2 PHE A 78 -1.266 33.817 -8.246 1.00 0.00 C ATOM 1227 CZ PHE A 78 0.127 33.704 -8.163 1.00 0.00 C ATOM 0 H PHE A 78 -0.540 30.423 -3.775 1.00 0.00 H new ATOM 0 HA PHE A 78 -2.703 32.438 -4.231 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -2.075 30.032 -6.015 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -3.421 31.134 -6.225 1.00 0.00 H new ATOM 0 HD1 PHE A 78 0.328 31.131 -5.943 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -3.158 33.049 -7.563 1.00 0.00 H new ATOM 0 HE1 PHE A 78 1.777 32.648 -7.266 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -1.710 34.564 -8.887 1.00 0.00 H new ATOM 0 HZ PHE A 78 0.758 34.364 -8.740 1.00 0.00 H new ATOM 1237 N ARG A 79 -4.261 30.898 -3.004 1.00 0.00 N ATOM 1238 CA ARG A 79 -5.144 29.967 -2.243 1.00 0.00 C ATOM 1239 C ARG A 79 -6.415 29.722 -3.058 1.00 0.00 C ATOM 1240 O ARG A 79 -6.923 30.610 -3.714 1.00 0.00 O ATOM 1241 CB ARG A 79 -5.501 30.570 -0.884 1.00 0.00 C ATOM 1242 CG ARG A 79 -6.025 29.468 0.038 1.00 0.00 C ATOM 1243 CD ARG A 79 -6.518 30.091 1.345 1.00 0.00 C ATOM 1244 NE ARG A 79 -7.104 29.029 2.212 1.00 0.00 N ATOM 1245 CZ ARG A 79 -6.616 28.818 3.403 1.00 0.00 C ATOM 1246 NH1 ARG A 79 -6.171 29.819 4.112 1.00 0.00 N ATOM 1247 NH2 ARG A 79 -6.574 27.606 3.885 1.00 0.00 N ATOM 0 H ARG A 79 -4.560 31.873 -3.015 1.00 0.00 H new ATOM 0 HA ARG A 79 -4.625 29.024 -2.074 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -4.624 31.043 -0.442 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -6.255 31.347 -1.005 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -6.836 28.927 -0.449 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -5.236 28.744 0.242 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -5.692 30.582 1.860 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -7.264 30.858 1.136 1.00 0.00 H new ATOM 0 HE ARG A 79 -7.886 28.468 1.874 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -6.205 30.766 3.735 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -5.789 29.654 5.043 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -6.923 26.824 3.330 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -6.192 27.440 4.816 1.00 0.00 H new ATOM 1261 N PHE A 80 -6.912 28.514 -3.054 1.00 0.00 N ATOM 1262 CA PHE A 80 -8.125 28.204 -3.862 1.00 0.00 C ATOM 1263 C PHE A 80 -9.241 27.625 -2.993 1.00 0.00 C ATOM 1264 O PHE A 80 -9.002 26.849 -2.092 1.00 0.00 O ATOM 1265 CB PHE A 80 -7.754 27.164 -4.913 1.00 0.00 C ATOM 1266 CG PHE A 80 -7.168 27.850 -6.121 1.00 0.00 C ATOM 1267 CD1 PHE A 80 -6.052 28.681 -5.978 1.00 0.00 C ATOM 1268 CD2 PHE A 80 -7.739 27.655 -7.384 1.00 0.00 C ATOM 1269 CE1 PHE A 80 -5.506 29.319 -7.096 1.00 0.00 C ATOM 1270 CE2 PHE A 80 -7.193 28.293 -8.503 1.00 0.00 C ATOM 1271 CZ PHE A 80 -6.074 29.125 -8.359 1.00 0.00 C ATOM 0 H PHE A 80 -6.530 27.729 -2.526 1.00 0.00 H new ATOM 0 HA PHE A 80 -8.480 29.128 -4.319 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -7.035 26.456 -4.500 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -8.636 26.592 -5.200 1.00 0.00 H new ATOM 0 HD1 PHE A 80 -5.612 28.830 -5.003 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -8.600 27.013 -7.495 1.00 0.00 H new ATOM 0 HE1 PHE A 80 -4.645 29.962 -6.984 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -7.634 28.145 -9.478 1.00 0.00 H new ATOM 0 HZ PHE A 80 -5.651 29.616 -9.223 1.00 0.00 H new ATOM 1281 N MET A 81 -10.464 27.973 -3.283 1.00 0.00 N ATOM 1282 CA MET A 81 -11.602 27.417 -2.500 1.00 0.00 C ATOM 1283 C MET A 81 -12.599 26.781 -3.472 1.00 0.00 C ATOM 1284 O MET A 81 -13.058 27.408 -4.406 1.00 0.00 O ATOM 1285 CB MET A 81 -12.284 28.525 -1.694 1.00 0.00 C ATOM 1286 CG MET A 81 -13.627 28.020 -1.166 1.00 0.00 C ATOM 1287 SD MET A 81 -14.239 29.150 0.109 1.00 0.00 S ATOM 1288 CE MET A 81 -14.666 27.893 1.340 1.00 0.00 C ATOM 0 H MET A 81 -10.724 28.619 -4.029 1.00 0.00 H new ATOM 0 HA MET A 81 -11.235 26.665 -1.801 1.00 0.00 H new ATOM 0 HB2 MET A 81 -11.647 28.830 -0.864 1.00 0.00 H new ATOM 0 HB3 MET A 81 -12.435 29.404 -2.320 1.00 0.00 H new ATOM 0 HG2 MET A 81 -14.347 27.950 -1.981 1.00 0.00 H new ATOM 0 HG3 MET A 81 -13.514 27.017 -0.754 1.00 0.00 H new ATOM 0 HE1 MET A 81 -15.749 27.780 1.384 1.00 0.00 H new ATOM 0 HE2 MET A 81 -14.213 26.942 1.061 1.00 0.00 H new ATOM 0 HE3 MET A 81 -14.293 28.200 2.317 1.00 0.00 H new ATOM 1298 N SER A 82 -12.915 25.528 -3.272 1.00 0.00 N ATOM 1299 CA SER A 82 -13.856 24.837 -4.195 1.00 0.00 C ATOM 1300 C SER A 82 -15.280 25.349 -3.969 1.00 0.00 C ATOM 1301 O SER A 82 -15.674 25.633 -2.855 1.00 0.00 O ATOM 1302 CB SER A 82 -13.819 23.333 -3.926 1.00 0.00 C ATOM 1303 OG SER A 82 -14.642 23.033 -2.807 1.00 0.00 O ATOM 0 H SER A 82 -12.560 24.955 -2.507 1.00 0.00 H new ATOM 0 HA SER A 82 -13.557 25.039 -5.224 1.00 0.00 H new ATOM 0 HB2 SER A 82 -14.166 22.787 -4.803 1.00 0.00 H new ATOM 0 HB3 SER A 82 -12.795 23.012 -3.735 1.00 0.00 H new ATOM 0 HG SER A 82 -15.352 22.415 -3.080 1.00 0.00 H new ATOM 1309 N LYS A 83 -16.058 25.449 -5.011 1.00 0.00 N ATOM 1310 CA LYS A 83 -17.460 25.927 -4.844 1.00 0.00 C ATOM 1311 C LYS A 83 -18.105 25.179 -3.674 1.00 0.00 C ATOM 1312 O LYS A 83 -18.770 25.762 -2.840 1.00 0.00 O ATOM 1313 CB LYS A 83 -18.250 25.654 -6.126 1.00 0.00 C ATOM 1314 CG LYS A 83 -17.867 26.681 -7.192 1.00 0.00 C ATOM 1315 CD LYS A 83 -18.790 26.528 -8.402 1.00 0.00 C ATOM 1316 CE LYS A 83 -18.333 27.469 -9.518 1.00 0.00 C ATOM 1317 NZ LYS A 83 -19.012 27.098 -10.790 1.00 0.00 N ATOM 0 H LYS A 83 -15.786 25.222 -5.967 1.00 0.00 H new ATOM 0 HA LYS A 83 -17.463 26.998 -4.643 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -18.042 24.646 -6.486 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -19.320 25.706 -5.924 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -17.946 27.689 -6.786 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -16.829 26.539 -7.493 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -18.777 25.497 -8.754 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -19.818 26.755 -8.119 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -18.567 28.501 -9.256 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -17.252 27.408 -9.640 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -18.701 27.738 -11.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -18.768 26.119 -11.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -20.042 27.178 -10.670 1.00 0.00 H new ATOM 1331 N GLY A 84 -17.915 23.888 -3.612 1.00 0.00 N ATOM 1332 CA GLY A 84 -18.514 23.084 -2.504 1.00 0.00 C ATOM 1333 C GLY A 84 -18.058 23.629 -1.144 1.00 0.00 C ATOM 1334 O GLY A 84 -18.492 23.168 -0.107 1.00 0.00 O ATOM 0 H GLY A 84 -17.367 23.352 -4.285 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -19.602 23.115 -2.570 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -18.218 22.039 -2.603 1.00 0.00 H new ATOM 1338 N GLY A 85 -17.199 24.612 -1.135 1.00 0.00 N ATOM 1339 CA GLY A 85 -16.738 25.184 0.162 1.00 0.00 C ATOM 1340 C GLY A 85 -15.416 24.540 0.585 1.00 0.00 C ATOM 1341 O GLY A 85 -15.076 24.513 1.751 1.00 0.00 O ATOM 0 H GLY A 85 -16.797 25.043 -1.968 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -16.611 26.262 0.067 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -17.494 25.018 0.930 1.00 0.00 H new ATOM 1345 N MET A 86 -14.661 24.032 -0.349 1.00 0.00 N ATOM 1346 CA MET A 86 -13.356 23.407 0.016 1.00 0.00 C ATOM 1347 C MET A 86 -12.247 24.437 -0.190 1.00 0.00 C ATOM 1348 O MET A 86 -12.345 25.290 -1.044 1.00 0.00 O ATOM 1349 CB MET A 86 -13.095 22.188 -0.872 1.00 0.00 C ATOM 1350 CG MET A 86 -14.317 21.267 -0.843 1.00 0.00 C ATOM 1351 SD MET A 86 -14.101 20.021 0.452 1.00 0.00 S ATOM 1352 CE MET A 86 -12.516 19.366 -0.125 1.00 0.00 C ATOM 0 H MET A 86 -14.888 24.022 -1.343 1.00 0.00 H new ATOM 0 HA MET A 86 -13.380 23.085 1.057 1.00 0.00 H new ATOM 0 HB2 MET A 86 -12.890 22.506 -1.894 1.00 0.00 H new ATOM 0 HB3 MET A 86 -12.213 21.651 -0.522 1.00 0.00 H new ATOM 0 HG2 MET A 86 -15.220 21.848 -0.656 1.00 0.00 H new ATOM 0 HG3 MET A 86 -14.444 20.783 -1.811 1.00 0.00 H new ATOM 0 HE1 MET A 86 -12.598 18.288 -0.267 1.00 0.00 H new ATOM 0 HE2 MET A 86 -12.250 19.838 -1.071 1.00 0.00 H new ATOM 0 HE3 MET A 86 -11.744 19.577 0.615 1.00 0.00 H new ATOM 1362 N ARG A 87 -11.205 24.389 0.591 1.00 0.00 N ATOM 1363 CA ARG A 87 -10.120 25.396 0.425 1.00 0.00 C ATOM 1364 C ARG A 87 -8.776 24.700 0.196 1.00 0.00 C ATOM 1365 O ARG A 87 -8.461 23.707 0.824 1.00 0.00 O ATOM 1366 CB ARG A 87 -10.035 26.259 1.684 1.00 0.00 C ATOM 1367 CG ARG A 87 -11.314 27.089 1.817 1.00 0.00 C ATOM 1368 CD ARG A 87 -11.170 28.066 2.986 1.00 0.00 C ATOM 1369 NE ARG A 87 -10.371 29.245 2.550 1.00 0.00 N ATOM 1370 CZ ARG A 87 -9.899 30.079 3.436 1.00 0.00 C ATOM 1371 NH1 ARG A 87 -10.165 29.907 4.703 1.00 0.00 N ATOM 1372 NH2 ARG A 87 -9.161 31.085 3.056 1.00 0.00 N ATOM 0 H ARG A 87 -11.057 23.703 1.331 1.00 0.00 H new ATOM 0 HA ARG A 87 -10.346 26.020 -0.440 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -9.905 25.628 2.563 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -9.166 26.915 1.631 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -11.503 27.636 0.893 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -12.170 26.434 1.980 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -12.154 28.386 3.330 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -10.683 27.574 3.828 1.00 0.00 H new ATOM 0 HE ARG A 87 -10.193 29.401 1.558 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -10.742 29.120 5.001 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -9.796 30.559 5.395 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -8.953 31.220 2.067 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -8.792 31.737 3.748 1.00 0.00 H new ATOM 1386 N ASN A 88 -7.974 25.232 -0.686 1.00 0.00 N ATOM 1387 CA ASN A 88 -6.638 24.633 -0.951 1.00 0.00 C ATOM 1388 C ASN A 88 -5.611 25.763 -1.039 1.00 0.00 C ATOM 1389 O ASN A 88 -5.889 26.822 -1.564 1.00 0.00 O ATOM 1390 CB ASN A 88 -6.670 23.857 -2.270 1.00 0.00 C ATOM 1391 CG ASN A 88 -7.822 22.851 -2.241 1.00 0.00 C ATOM 1392 OD1 ASN A 88 -8.809 23.019 -2.930 1.00 0.00 O ATOM 1393 ND2 ASN A 88 -7.738 21.804 -1.466 1.00 0.00 N ATOM 0 H ASN A 88 -8.190 26.062 -1.238 1.00 0.00 H new ATOM 0 HA ASN A 88 -6.370 23.946 -0.148 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -6.795 24.545 -3.106 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -5.724 23.338 -2.422 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -8.501 21.127 -1.439 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -6.910 21.663 -0.888 1.00 0.00 H new ATOM 1400 N VAL A 89 -4.433 25.561 -0.516 1.00 0.00 N ATOM 1401 CA VAL A 89 -3.414 26.647 -0.564 1.00 0.00 C ATOM 1402 C VAL A 89 -2.155 26.158 -1.282 1.00 0.00 C ATOM 1403 O VAL A 89 -1.674 25.067 -1.045 1.00 0.00 O ATOM 1404 CB VAL A 89 -3.052 27.067 0.862 1.00 0.00 C ATOM 1405 CG1 VAL A 89 -2.319 28.410 0.828 1.00 0.00 C ATOM 1406 CG2 VAL A 89 -4.328 27.204 1.694 1.00 0.00 C ATOM 0 H VAL A 89 -4.134 24.699 -0.061 1.00 0.00 H new ATOM 0 HA VAL A 89 -3.827 27.497 -1.107 1.00 0.00 H new ATOM 0 HB VAL A 89 -2.406 26.311 1.310 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -2.061 28.710 1.844 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -1.409 28.313 0.236 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -2.964 29.166 0.380 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -4.070 27.503 2.710 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -4.975 27.959 1.247 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -4.850 26.248 1.719 1.00 0.00 H new ATOM 1416 N PHE A 90 -1.611 26.969 -2.147 1.00 0.00 N ATOM 1417 CA PHE A 90 -0.374 26.569 -2.871 1.00 0.00 C ATOM 1418 C PHE A 90 0.702 27.626 -2.624 1.00 0.00 C ATOM 1419 O PHE A 90 0.513 28.794 -2.904 1.00 0.00 O ATOM 1420 CB PHE A 90 -0.653 26.470 -4.371 1.00 0.00 C ATOM 1421 CG PHE A 90 -1.858 25.591 -4.612 1.00 0.00 C ATOM 1422 CD1 PHE A 90 -2.054 24.442 -3.836 1.00 0.00 C ATOM 1423 CD2 PHE A 90 -2.777 25.926 -5.613 1.00 0.00 C ATOM 1424 CE1 PHE A 90 -3.171 23.628 -4.062 1.00 0.00 C ATOM 1425 CE2 PHE A 90 -3.894 25.113 -5.839 1.00 0.00 C ATOM 1426 CZ PHE A 90 -4.091 23.964 -5.064 1.00 0.00 C ATOM 0 H PHE A 90 -1.972 27.893 -2.383 1.00 0.00 H new ATOM 0 HA PHE A 90 -0.038 25.597 -2.510 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -0.828 27.464 -4.784 1.00 0.00 H new ATOM 0 HB3 PHE A 90 0.216 26.060 -4.885 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -1.344 24.184 -3.064 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -2.624 26.812 -6.211 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -3.323 22.742 -3.464 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -4.603 25.372 -6.611 1.00 0.00 H new ATOM 0 HZ PHE A 90 -4.952 23.336 -5.238 1.00 0.00 H new ATOM 1436 N ASP A 91 1.826 27.231 -2.095 1.00 0.00 N ATOM 1437 CA ASP A 91 2.905 28.220 -1.826 1.00 0.00 C ATOM 1438 C ASP A 91 3.938 28.180 -2.952 1.00 0.00 C ATOM 1439 O ASP A 91 4.234 27.139 -3.505 1.00 0.00 O ATOM 1440 CB ASP A 91 3.584 27.885 -0.496 1.00 0.00 C ATOM 1441 CG ASP A 91 4.589 28.984 -0.145 1.00 0.00 C ATOM 1442 OD1 ASP A 91 4.696 29.928 -0.910 1.00 0.00 O ATOM 1443 OD2 ASP A 91 5.235 28.861 0.883 1.00 0.00 O ATOM 0 H ASP A 91 2.043 26.268 -1.838 1.00 0.00 H new ATOM 0 HA ASP A 91 2.472 29.219 -1.773 1.00 0.00 H new ATOM 0 HB2 ASP A 91 2.837 27.795 0.293 1.00 0.00 H new ATOM 0 HB3 ASP A 91 4.091 26.923 -0.567 1.00 0.00 H new ATOM 1448 N GLU A 92 4.498 29.310 -3.283 1.00 0.00 N ATOM 1449 CA GLU A 92 5.524 29.354 -4.361 1.00 0.00 C ATOM 1450 C GLU A 92 4.971 28.737 -5.649 1.00 0.00 C ATOM 1451 O GLU A 92 5.583 27.866 -6.233 1.00 0.00 O ATOM 1452 CB GLU A 92 6.758 28.568 -3.916 1.00 0.00 C ATOM 1453 CG GLU A 92 7.936 28.908 -4.832 1.00 0.00 C ATOM 1454 CD GLU A 92 9.111 27.980 -4.517 1.00 0.00 C ATOM 1455 OE1 GLU A 92 9.019 27.251 -3.543 1.00 0.00 O ATOM 1456 OE2 GLU A 92 10.082 28.013 -5.254 1.00 0.00 O ATOM 0 H GLU A 92 4.288 30.210 -2.851 1.00 0.00 H new ATOM 0 HA GLU A 92 5.791 30.393 -4.552 1.00 0.00 H new ATOM 0 HB2 GLU A 92 7.005 28.812 -2.883 1.00 0.00 H new ATOM 0 HB3 GLU A 92 6.553 27.498 -3.951 1.00 0.00 H new ATOM 0 HG2 GLU A 92 7.642 28.799 -5.876 1.00 0.00 H new ATOM 0 HG3 GLU A 92 8.232 29.948 -4.691 1.00 0.00 H new ATOM 1463 N VAL A 93 3.831 29.180 -6.108 1.00 0.00 N ATOM 1464 CA VAL A 93 3.274 28.610 -7.369 1.00 0.00 C ATOM 1465 C VAL A 93 3.956 29.281 -8.563 1.00 0.00 C ATOM 1466 O VAL A 93 4.195 28.664 -9.582 1.00 0.00 O ATOM 1467 CB VAL A 93 1.767 28.873 -7.429 1.00 0.00 C ATOM 1468 CG1 VAL A 93 1.211 28.349 -8.756 1.00 0.00 C ATOM 1469 CG2 VAL A 93 1.072 28.159 -6.268 1.00 0.00 C ATOM 0 H VAL A 93 3.265 29.906 -5.669 1.00 0.00 H new ATOM 0 HA VAL A 93 3.453 27.535 -7.397 1.00 0.00 H new ATOM 0 HB VAL A 93 1.584 29.945 -7.354 1.00 0.00 H new ATOM 0 HG11 VAL A 93 0.138 28.536 -8.800 1.00 0.00 H new ATOM 0 HG12 VAL A 93 1.702 28.860 -9.584 1.00 0.00 H new ATOM 0 HG13 VAL A 93 1.396 27.277 -8.830 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -0.000 28.348 -6.314 1.00 0.00 H new ATOM 0 HG22 VAL A 93 1.254 27.087 -6.339 1.00 0.00 H new ATOM 0 HG23 VAL A 93 1.466 28.532 -5.323 1.00 0.00 H new ATOM 1479 N ILE A 94 4.278 30.539 -8.440 1.00 0.00 N ATOM 1480 CA ILE A 94 4.953 31.251 -9.559 1.00 0.00 C ATOM 1481 C ILE A 94 6.105 32.083 -8.995 1.00 0.00 C ATOM 1482 O ILE A 94 5.938 32.826 -8.047 1.00 0.00 O ATOM 1483 CB ILE A 94 3.945 32.163 -10.265 1.00 0.00 C ATOM 1484 CG1 ILE A 94 3.024 31.315 -11.145 1.00 0.00 C ATOM 1485 CG2 ILE A 94 4.691 33.175 -11.136 1.00 0.00 C ATOM 1486 CD1 ILE A 94 1.857 32.170 -11.643 1.00 0.00 C ATOM 0 H ILE A 94 4.102 31.105 -7.610 1.00 0.00 H new ATOM 0 HA ILE A 94 5.343 30.531 -10.278 1.00 0.00 H new ATOM 0 HB ILE A 94 3.352 32.694 -9.520 1.00 0.00 H new ATOM 0 HG12 ILE A 94 3.581 30.914 -11.992 1.00 0.00 H new ATOM 0 HG13 ILE A 94 2.648 30.463 -10.579 1.00 0.00 H new ATOM 0 HG21 ILE A 94 3.972 33.823 -11.638 1.00 0.00 H new ATOM 0 HG22 ILE A 94 5.349 33.778 -10.510 1.00 0.00 H new ATOM 0 HG23 ILE A 94 5.284 32.646 -11.882 1.00 0.00 H new ATOM 0 HD11 ILE A 94 1.203 31.563 -12.269 1.00 0.00 H new ATOM 0 HD12 ILE A 94 1.294 32.549 -10.790 1.00 0.00 H new ATOM 0 HD13 ILE A 94 2.242 33.008 -12.225 1.00 0.00 H new ATOM 1498 N PRO A 95 7.303 31.941 -9.579 1.00 0.00 N ATOM 1499 CA PRO A 95 8.493 32.668 -9.123 1.00 0.00 C ATOM 1500 C PRO A 95 8.426 34.156 -9.475 1.00 0.00 C ATOM 1501 O PRO A 95 7.691 34.568 -10.350 1.00 0.00 O ATOM 1502 CB PRO A 95 9.636 31.998 -9.881 1.00 0.00 C ATOM 1503 CG PRO A 95 9.000 31.429 -11.105 1.00 0.00 C ATOM 1504 CD PRO A 95 7.589 31.067 -10.730 1.00 0.00 C ATOM 0 HA PRO A 95 8.604 32.629 -8.039 1.00 0.00 H new ATOM 0 HB2 PRO A 95 10.415 32.716 -10.137 1.00 0.00 H new ATOM 0 HB3 PRO A 95 10.106 31.219 -9.281 1.00 0.00 H new ATOM 0 HG2 PRO A 95 9.010 32.154 -11.919 1.00 0.00 H new ATOM 0 HG3 PRO A 95 9.545 30.552 -11.452 1.00 0.00 H new ATOM 0 HD2 PRO A 95 6.897 31.247 -11.552 1.00 0.00 H new ATOM 0 HD3 PRO A 95 7.502 30.013 -10.465 1.00 0.00 H new ATOM 1512 N THR A 96 9.188 34.967 -8.792 1.00 0.00 N ATOM 1513 CA THR A 96 9.171 36.429 -9.077 1.00 0.00 C ATOM 1514 C THR A 96 9.345 36.663 -10.578 1.00 0.00 C ATOM 1515 O THR A 96 8.758 37.563 -11.145 1.00 0.00 O ATOM 1516 CB THR A 96 10.314 37.110 -8.321 1.00 0.00 C ATOM 1517 OG1 THR A 96 10.241 36.767 -6.945 1.00 0.00 O ATOM 1518 CG2 THR A 96 10.200 38.627 -8.478 1.00 0.00 C ATOM 0 H THR A 96 9.823 34.679 -8.047 1.00 0.00 H new ATOM 0 HA THR A 96 8.218 36.848 -8.753 1.00 0.00 H new ATOM 0 HB THR A 96 11.268 36.776 -8.728 1.00 0.00 H new ATOM 0 HG1 THR A 96 10.973 37.202 -6.460 1.00 0.00 H new ATOM 0 HG21 THR A 96 11.015 39.111 -7.939 1.00 0.00 H new ATOM 0 HG22 THR A 96 10.258 38.889 -9.535 1.00 0.00 H new ATOM 0 HG23 THR A 96 9.246 38.964 -8.072 1.00 0.00 H new ATOM 1526 N ALA A 97 10.147 35.866 -11.230 1.00 0.00 N ATOM 1527 CA ALA A 97 10.349 36.061 -12.692 1.00 0.00 C ATOM 1528 C ALA A 97 9.541 35.017 -13.463 1.00 0.00 C ATOM 1529 O ALA A 97 9.934 33.873 -13.576 1.00 0.00 O ATOM 1530 CB ALA A 97 11.834 35.912 -13.030 1.00 0.00 C ATOM 0 H ALA A 97 10.668 35.093 -10.816 1.00 0.00 H new ATOM 0 HA ALA A 97 10.014 37.059 -12.973 1.00 0.00 H new ATOM 0 HB1 ALA A 97 11.980 36.055 -14.101 1.00 0.00 H new ATOM 0 HB2 ALA A 97 12.409 36.659 -12.483 1.00 0.00 H new ATOM 0 HB3 ALA A 97 12.173 34.915 -12.748 1.00 0.00 H new ATOM 1536 N PHE A 98 8.414 35.401 -13.997 1.00 0.00 N ATOM 1537 CA PHE A 98 7.584 34.429 -14.763 1.00 0.00 C ATOM 1538 C PHE A 98 7.636 34.786 -16.248 1.00 0.00 C ATOM 1539 O PHE A 98 7.799 35.933 -16.614 1.00 0.00 O ATOM 1540 CB PHE A 98 6.137 34.492 -14.271 1.00 0.00 C ATOM 1541 CG PHE A 98 5.611 35.900 -14.429 1.00 0.00 C ATOM 1542 CD1 PHE A 98 4.989 36.284 -15.623 1.00 0.00 C ATOM 1543 CD2 PHE A 98 5.745 36.819 -13.382 1.00 0.00 C ATOM 1544 CE1 PHE A 98 4.501 37.588 -15.770 1.00 0.00 C ATOM 1545 CE2 PHE A 98 5.256 38.123 -13.529 1.00 0.00 C ATOM 1546 CZ PHE A 98 4.635 38.508 -14.722 1.00 0.00 C ATOM 0 H PHE A 98 8.032 36.345 -13.936 1.00 0.00 H new ATOM 0 HA PHE A 98 7.970 33.420 -14.615 1.00 0.00 H new ATOM 0 HB2 PHE A 98 5.519 33.796 -14.838 1.00 0.00 H new ATOM 0 HB3 PHE A 98 6.084 34.188 -13.226 1.00 0.00 H new ATOM 0 HD1 PHE A 98 4.886 35.574 -16.431 1.00 0.00 H new ATOM 0 HD2 PHE A 98 6.225 36.523 -12.461 1.00 0.00 H new ATOM 0 HE1 PHE A 98 4.021 37.885 -16.691 1.00 0.00 H new ATOM 0 HE2 PHE A 98 5.358 38.832 -12.721 1.00 0.00 H new ATOM 0 HZ PHE A 98 4.259 39.514 -14.835 1.00 0.00 H new ATOM 1556 N SER A 99 7.499 33.816 -17.110 1.00 0.00 N ATOM 1557 CA SER A 99 7.541 34.110 -18.568 1.00 0.00 C ATOM 1558 C SER A 99 6.122 34.073 -19.134 1.00 0.00 C ATOM 1559 O SER A 99 5.195 33.636 -18.481 1.00 0.00 O ATOM 1560 CB SER A 99 8.402 33.061 -19.276 1.00 0.00 C ATOM 1561 OG SER A 99 9.573 33.678 -19.788 1.00 0.00 O ATOM 0 H SER A 99 7.360 32.835 -16.867 1.00 0.00 H new ATOM 0 HA SER A 99 7.971 35.099 -18.728 1.00 0.00 H new ATOM 0 HB2 SER A 99 8.671 32.266 -18.580 1.00 0.00 H new ATOM 0 HB3 SER A 99 7.838 32.598 -20.086 1.00 0.00 H new ATOM 0 HG SER A 99 9.868 33.202 -20.592 1.00 0.00 H new ATOM 1567 N ILE A 100 5.943 34.524 -20.344 1.00 0.00 N ATOM 1568 CA ILE A 100 4.579 34.507 -20.942 1.00 0.00 C ATOM 1569 C ILE A 100 4.463 33.317 -21.894 1.00 0.00 C ATOM 1570 O ILE A 100 5.356 33.040 -22.670 1.00 0.00 O ATOM 1571 CB ILE A 100 4.335 35.808 -21.710 1.00 0.00 C ATOM 1572 CG1 ILE A 100 4.633 37.002 -20.801 1.00 0.00 C ATOM 1573 CG2 ILE A 100 2.875 35.864 -22.163 1.00 0.00 C ATOM 1574 CD1 ILE A 100 3.543 37.114 -19.732 1.00 0.00 C ATOM 0 H ILE A 100 6.678 34.902 -20.942 1.00 0.00 H new ATOM 0 HA ILE A 100 3.835 34.416 -20.151 1.00 0.00 H new ATOM 0 HB ILE A 100 4.989 35.844 -22.581 1.00 0.00 H new ATOM 0 HG12 ILE A 100 5.608 36.879 -20.330 1.00 0.00 H new ATOM 0 HG13 ILE A 100 4.676 37.919 -21.389 1.00 0.00 H new ATOM 0 HG21 ILE A 100 2.699 36.790 -22.710 1.00 0.00 H new ATOM 0 HG22 ILE A 100 2.662 35.014 -22.811 1.00 0.00 H new ATOM 0 HG23 ILE A 100 2.222 35.828 -21.291 1.00 0.00 H new ATOM 0 HD11 ILE A 100 3.755 37.965 -19.084 1.00 0.00 H new ATOM 0 HD12 ILE A 100 2.575 37.256 -20.213 1.00 0.00 H new ATOM 0 HD13 ILE A 100 3.522 36.201 -19.137 1.00 0.00 H new ATOM 1586 N GLY A 101 3.369 32.608 -21.842 1.00 0.00 N ATOM 1587 CA GLY A 101 3.199 31.436 -22.743 1.00 0.00 C ATOM 1588 C GLY A 101 3.632 30.162 -22.014 1.00 0.00 C ATOM 1589 O GLY A 101 3.588 29.078 -22.564 1.00 0.00 O ATOM 0 H GLY A 101 2.586 32.790 -21.214 1.00 0.00 H new ATOM 0 HA2 GLY A 101 2.158 31.353 -23.055 1.00 0.00 H new ATOM 0 HA3 GLY A 101 3.793 31.570 -23.647 1.00 0.00 H new ATOM 1593 N LYS A 102 4.046 30.276 -20.780 1.00 0.00 N ATOM 1594 CA LYS A 102 4.473 29.061 -20.031 1.00 0.00 C ATOM 1595 C LYS A 102 3.503 28.818 -18.874 1.00 0.00 C ATOM 1596 O LYS A 102 2.991 29.746 -18.279 1.00 0.00 O ATOM 1597 CB LYS A 102 5.887 29.261 -19.485 1.00 0.00 C ATOM 1598 CG LYS A 102 6.880 29.312 -20.645 1.00 0.00 C ATOM 1599 CD LYS A 102 8.302 29.419 -20.096 1.00 0.00 C ATOM 1600 CE LYS A 102 9.118 30.367 -20.976 1.00 0.00 C ATOM 1601 NZ LYS A 102 9.938 29.573 -21.933 1.00 0.00 N ATOM 0 H LYS A 102 4.106 31.153 -20.262 1.00 0.00 H new ATOM 0 HA LYS A 102 4.469 28.200 -20.699 1.00 0.00 H new ATOM 0 HB2 LYS A 102 5.938 30.184 -18.908 1.00 0.00 H new ATOM 0 HB3 LYS A 102 6.145 28.447 -18.807 1.00 0.00 H new ATOM 0 HG2 LYS A 102 6.783 28.417 -21.260 1.00 0.00 H new ATOM 0 HG3 LYS A 102 6.662 30.165 -21.287 1.00 0.00 H new ATOM 0 HD2 LYS A 102 8.280 29.786 -19.070 1.00 0.00 H new ATOM 0 HD3 LYS A 102 8.769 28.435 -20.073 1.00 0.00 H new ATOM 0 HE2 LYS A 102 8.453 31.038 -21.520 1.00 0.00 H new ATOM 0 HE3 LYS A 102 9.764 30.990 -20.357 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 10.493 30.217 -22.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 10.582 28.950 -21.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 9.312 28.997 -22.532 1.00 0.00 H new ATOM 1615 N THR A 103 3.236 27.583 -18.555 1.00 0.00 N ATOM 1616 CA THR A 103 2.286 27.301 -17.444 1.00 0.00 C ATOM 1617 C THR A 103 3.028 27.392 -16.109 1.00 0.00 C ATOM 1618 O THR A 103 4.223 27.616 -16.072 1.00 0.00 O ATOM 1619 CB THR A 103 1.712 25.892 -17.613 1.00 0.00 C ATOM 1620 OG1 THR A 103 1.402 25.671 -18.982 1.00 0.00 O ATOM 1621 CG2 THR A 103 0.444 25.749 -16.771 1.00 0.00 C ATOM 0 H THR A 103 3.632 26.761 -19.012 1.00 0.00 H new ATOM 0 HA THR A 103 1.475 28.029 -17.461 1.00 0.00 H new ATOM 0 HB THR A 103 2.447 25.158 -17.283 1.00 0.00 H new ATOM 0 HG1 THR A 103 1.036 24.769 -19.093 1.00 0.00 H new ATOM 0 HG21 THR A 103 0.037 24.745 -16.893 1.00 0.00 H new ATOM 0 HG22 THR A 103 0.683 25.918 -15.721 1.00 0.00 H new ATOM 0 HG23 THR A 103 -0.294 26.482 -17.098 1.00 0.00 H new ATOM 1629 N TYR A 104 2.348 27.206 -15.012 1.00 0.00 N ATOM 1630 CA TYR A 104 3.034 27.266 -13.692 1.00 0.00 C ATOM 1631 C TYR A 104 2.152 26.584 -12.645 1.00 0.00 C ATOM 1632 O TYR A 104 1.283 27.197 -12.056 1.00 0.00 O ATOM 1633 CB TYR A 104 3.275 28.723 -13.293 1.00 0.00 C ATOM 1634 CG TYR A 104 4.569 29.206 -13.905 1.00 0.00 C ATOM 1635 CD1 TYR A 104 5.780 28.597 -13.554 1.00 0.00 C ATOM 1636 CD2 TYR A 104 4.557 30.261 -14.825 1.00 0.00 C ATOM 1637 CE1 TYR A 104 6.979 29.044 -14.122 1.00 0.00 C ATOM 1638 CE2 TYR A 104 5.755 30.708 -15.393 1.00 0.00 C ATOM 1639 CZ TYR A 104 6.967 30.101 -15.042 1.00 0.00 C ATOM 1640 OH TYR A 104 8.148 30.541 -15.602 1.00 0.00 O ATOM 0 H TYR A 104 1.347 27.015 -14.973 1.00 0.00 H new ATOM 0 HA TYR A 104 3.995 26.757 -13.756 1.00 0.00 H new ATOM 0 HB2 TYR A 104 2.446 29.345 -13.631 1.00 0.00 H new ATOM 0 HB3 TYR A 104 3.319 28.811 -12.207 1.00 0.00 H new ATOM 0 HD1 TYR A 104 5.789 27.782 -12.845 1.00 0.00 H new ATOM 0 HD2 TYR A 104 3.623 30.730 -15.096 1.00 0.00 H new ATOM 0 HE1 TYR A 104 7.913 28.574 -13.851 1.00 0.00 H new ATOM 0 HE2 TYR A 104 5.745 31.522 -16.103 1.00 0.00 H new ATOM 0 HH TYR A 104 7.973 30.892 -16.500 1.00 0.00 H new ATOM 1650 N LYS A 105 2.358 25.317 -12.418 1.00 0.00 N ATOM 1651 CA LYS A 105 1.524 24.592 -11.420 1.00 0.00 C ATOM 1652 C LYS A 105 2.057 24.856 -10.010 1.00 0.00 C ATOM 1653 O LYS A 105 3.218 25.160 -9.821 1.00 0.00 O ATOM 1654 CB LYS A 105 1.571 23.091 -11.708 1.00 0.00 C ATOM 1655 CG LYS A 105 1.595 22.862 -13.220 1.00 0.00 C ATOM 1656 CD LYS A 105 0.527 21.833 -13.596 1.00 0.00 C ATOM 1657 CE LYS A 105 1.145 20.435 -13.597 1.00 0.00 C ATOM 1658 NZ LYS A 105 0.179 19.463 -13.011 1.00 0.00 N ATOM 0 H LYS A 105 3.069 24.751 -12.881 1.00 0.00 H new ATOM 0 HA LYS A 105 0.495 24.945 -11.489 1.00 0.00 H new ATOM 0 HB2 LYS A 105 2.455 22.649 -11.249 1.00 0.00 H new ATOM 0 HB3 LYS A 105 0.704 22.598 -11.269 1.00 0.00 H new ATOM 0 HG2 LYS A 105 1.412 23.800 -13.744 1.00 0.00 H new ATOM 0 HG3 LYS A 105 2.579 22.511 -13.530 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -0.300 21.876 -12.888 1.00 0.00 H new ATOM 0 HD3 LYS A 105 0.117 22.062 -14.580 1.00 0.00 H new ATOM 0 HE2 LYS A 105 1.402 20.140 -14.615 1.00 0.00 H new ATOM 0 HE3 LYS A 105 2.071 20.435 -13.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 0.600 18.512 -13.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -0.045 19.742 -12.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -0.693 19.456 -13.577 1.00 0.00 H new ATOM 1672 N PRO A 106 1.180 24.732 -9.005 1.00 0.00 N ATOM 1673 CA PRO A 106 1.546 24.950 -7.601 1.00 0.00 C ATOM 1674 C PRO A 106 2.465 23.846 -7.073 1.00 0.00 C ATOM 1675 O PRO A 106 2.401 22.711 -7.506 1.00 0.00 O ATOM 1676 CB PRO A 106 0.205 24.909 -6.870 1.00 0.00 C ATOM 1677 CG PRO A 106 -0.677 24.088 -7.749 1.00 0.00 C ATOM 1678 CD PRO A 106 -0.240 24.367 -9.159 1.00 0.00 C ATOM 0 HA PRO A 106 2.093 25.882 -7.462 1.00 0.00 H new ATOM 0 HB2 PRO A 106 0.306 24.462 -5.881 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -0.200 25.911 -6.727 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -0.582 23.028 -7.515 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -1.725 24.353 -7.606 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -0.364 23.494 -9.799 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -0.817 25.176 -9.607 1.00 0.00 H new